Murcko scaffold
2-({4-Oxo-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-6-yl}sulfanyl)-N-phenylacetamide scaffold
75 chemicals on CompoundList share this ring system.
- Rings
- 3
- Scaffold atoms
- 21
- Chemicals
- 75
- With full pages
- 27
Scaffold SMILES
O=C(CSc1nc2[nH]ncc2c(=O)[nH]1)Nc1ccccc1
A Bemis-Murcko scaffold is what remains of a molecule when every side chain is removed: the rings and the chains that link them. Chemicals that share a scaffold often belong to the same compound series, which helps when you look for analogues, alternative suppliers or related building blocks.
![Murcko scaffold O=C(CSc1nc2[nH]ncc2c(=O)[nH]1)Nc1ccccc1](/scaffold/PNAFPQXRNDJUPV-UHFFFAOYSA-N/structure.svg)
Computed from the structures of the chemicals listed here. Stereo and charges are removed before the scaffold is taken.
Chemicals with this scaffold
Open one to see its structure, properties and suppliers.
Showing 1 to 48 of 75 chemicals
![2-((1-(2-Hydroxyethyl)-4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)-N-(3-nitrophenyl)acetamide chemical structure, C15H14N6O5S, CAS 946379-51-7](/s/SFUMBCJUMAXBNJ-UHFFFAOYSA-N.svg)
2-((1-(2-Hydroxyethyl)-4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)-N-(3-nitrophenyl)acetamide
CAS 946379-51-7C15H14N6O5S
![N-(3-Nitrophenyl)-2-((4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamide chemical structure, C13H10N6O4S, CAS 877630-03-0](/s/LCSPTNNPKHKQDR-UHFFFAOYSA-N.svg)
N-(3-Nitrophenyl)-2-((4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamide
CAS 877630-03-0C13H10N6O4S
![N-(4-Nitrophenyl)-2-((4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamide chemical structure, C13H10N6O4S, CAS 877630-04-1](/s/USPCHICTALMZMR-UHFFFAOYSA-N.svg)
N-(4-Nitrophenyl)-2-((4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamide
CAS 877630-04-1C13H10N6O4S
![N-(3,5-Dimethylphenyl)-2-((4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamide chemical structure, C15H15N5O2S, CAS 878066-61-6](/s/NDMAEUIDKBBBPL-UHFFFAOYSA-N.svg)
N-(3,5-Dimethylphenyl)-2-((4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamide
CAS 878066-61-6C15H15N5O2S
![N-(2,3-Dimethylphenyl)-2-[(4-oxo-1,2-dihydropyrazolo[3,4-d]pyrimidin-6-yl)sulfanyl]acetamide chemical structure, C15H15N5O2S, CAS 878066-50-3](/s/UCAKZHVNRQPGCD-UHFFFAOYSA-N.svg)
N-(2,3-Dimethylphenyl)-2-[(4-oxo-1,2-dihydropyrazolo[3,4-d]pyrimidin-6-yl)sulfanyl]acetamide
CAS 878066-50-3C15H15N5O2S
![N-(3-Methylphenyl)-2-[(4-oxo-1,2-dihydropyrazolo[3,4-d]pyrimidin-6-yl)sulfanyl]acetamide chemical structure, C14H13N5O2S, CAS 878066-44-5](/s/BGKAMXISXARWKZ-UHFFFAOYSA-N.svg)
N-(3-Methylphenyl)-2-[(4-oxo-1,2-dihydropyrazolo[3,4-d]pyrimidin-6-yl)sulfanyl]acetamide
CAS 878066-44-5C14H13N5O2S
![N-(2,5-Dimethylphenyl)-2-((4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamide chemical structure, C15H15N5O2S, CAS 878066-53-6](/s/OOYDYMMANULROT-UHFFFAOYSA-N.svg)
N-(2,5-Dimethylphenyl)-2-((4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamide
CAS 878066-53-6C15H15N5O2S
![N-(4-Ethylphenyl)-2-((4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamide chemical structure, C15H15N5O2S, CAS 878066-69-4](/s/NPKNJJGNKMSTMK-UHFFFAOYSA-N.svg)
N-(4-Ethylphenyl)-2-((4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamide
CAS 878066-69-4C15H15N5O2S
![2-({4-Oxo-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-6-yl}sulfanyl)-N-(2,4,6-trimethylphenyl)acetamide chemical structure, C16H17N5O2S, CAS 878066-65-0](/s/DNOXEWVRKGPJTM-UHFFFAOYSA-N.svg)
2-({4-Oxo-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-6-yl}sulfanyl)-N-(2,4,6-trimethylphenyl)acetamide
CAS 878066-65-0C16H17N5O2S
![N-(2,4-Dimethylphenyl)-2-((4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamide chemical structure, C15H15N5O2S, CAS 878066-57-0](/s/FNAGMBHOWAZKIK-UHFFFAOYSA-N.svg)
N-(2,4-Dimethylphenyl)-2-((4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamide
CAS 878066-57-0C15H15N5O2S
![2-((4-Oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)-N-(p-tolyl)acetamide chemical structure, C14H13N5O2S, CAS 878066-47-8](/s/DTWPMISNSQCVOK-UHFFFAOYSA-N.svg)
2-((4-Oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)-N-(p-tolyl)acetamide
CAS 878066-47-8C14H13N5O2S
![2-({4-Oxo-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-6-yl}sulfanyl)-N-phenylacetamide chemical structure, C13H11N5O2S, CAS 878066-36-5](/s/PNAFPQXRNDJUPV-UHFFFAOYSA-N.svg)
2-({4-Oxo-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-6-yl}sulfanyl)-N-phenylacetamide
CAS 878066-36-5C13H11N5O2S
![Methyl 4-(2-((1-(2-hydroxyethyl)-4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamido)benzoate chemical structure, C17H17N5O5S, CAS 1005308-59-7](/s/TUMHHMKVOIBAGL-UHFFFAOYSA-N.svg)
Methyl 4-(2-((1-(2-hydroxyethyl)-4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamido)benzoate
CAS 1005308-59-7C17H17N5O5S
![N-(3-Chlorophenyl)-2-((1-(2-hydroxyethyl)-4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamide chemical structure, C15H14ClN5O3S, CAS 946333-04-6](/s/DIDKAOCSFAQHRR-UHFFFAOYSA-N.svg)
N-(3-Chlorophenyl)-2-((1-(2-hydroxyethyl)-4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamide
CAS 946333-04-6C15H14ClN5O3S
![N-(5-Chloro-2-methoxyphenyl)-2-((1-(2-hydroxyethyl)-4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamide chemical structure, C16H16ClN5O4S, CAS 946379-81-3](/s/GVCCLKKWEIMREU-UHFFFAOYSA-N.svg)
N-(5-Chloro-2-methoxyphenyl)-2-((1-(2-hydroxyethyl)-4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamide
CAS 946379-81-3C16H16ClN5O4S
![2-((4-Oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)-N-(o-tolyl)acetamide chemical structure, C14H13N5O2S, CAS 878066-42-3](/s/DWYZEAZGOQPKOX-UHFFFAOYSA-N.svg)
2-((4-Oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)-N-(o-tolyl)acetamide
CAS 878066-42-3C14H13N5O2S
![N-(4-Butylphenyl)-2-((4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamide chemical structure, C17H19N5O2S, CAS 878066-73-0](/s/DMMZSCQDNYGFGU-UHFFFAOYSA-N.svg)
N-(4-Butylphenyl)-2-((4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamide
CAS 878066-73-0C17H19N5O2S
![N-(2-Fluorophenyl)-2-((4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamide chemical structure, C13H10FN5O2S, CAS 878066-76-3](/s/IYFHXRQHVKGUQX-UHFFFAOYSA-N.svg)
N-(2-Fluorophenyl)-2-((4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamide
CAS 878066-76-3C13H10FN5O2S
![N-(4-Fluorophenyl)-2-((4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamide chemical structure, C13H10FN5O2S, CAS 878066-82-1](/s/PVZNZMRCHWXQDX-UHFFFAOYSA-N.svg)
N-(4-Fluorophenyl)-2-((4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamide
CAS 878066-82-1C13H10FN5O2S
![N-(2,4-Difluorophenyl)-2-((4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamide chemical structure, C13H9F2N5O2S, CAS 877629-88-4](/s/BPXMGWGPYSVWCI-UHFFFAOYSA-N.svg)
N-(2,4-Difluorophenyl)-2-((4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamide
CAS 877629-88-4C13H9F2N5O2S
![N-(2-Methoxyphenyl)-2-((4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamide chemical structure, C14H13N5O3S, CAS 877629-89-5](/s/HMJPOIHSEWGOFS-UHFFFAOYSA-N.svg)
N-(2-Methoxyphenyl)-2-((4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamide
CAS 877629-89-5C14H13N5O3S
![N-(3-Methoxyphenyl)-2-((4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamide chemical structure, C14H13N5O3S, CAS 877629-90-8](/s/DHXUGEVGVNHURI-UHFFFAOYSA-N.svg)
N-(3-Methoxyphenyl)-2-((4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamide
CAS 877629-90-8C14H13N5O3S
![N-(4-Methoxyphenyl)-2-({4-oxo-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-6-yl}sulfanyl)acetamide chemical structure, C14H13N5O3S, CAS 877629-91-9](/s/DSPLXPNPMWFKRX-UHFFFAOYSA-N.svg)
N-(4-Methoxyphenyl)-2-({4-oxo-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-6-yl}sulfanyl)acetamide
CAS 877629-91-9C14H13N5O3S
![N-(2-Ethoxyphenyl)-2-((4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamide chemical structure, C15H15N5O3S, CAS 877629-92-0](/s/CKTXCEQENLHOLH-UHFFFAOYSA-N.svg)
N-(2-Ethoxyphenyl)-2-((4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamide
CAS 877629-92-0C15H15N5O3S
- N-(4-Ethoxyphenyl)-2-((4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamide877629-93-1C15H15N5O3S
- N-(2,4-Dimethoxyphenyl)-2-((4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamide877629-94-2C15H15N5O4S
- N-(2,5-Dimethoxyphenyl)-2-((4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamide877629-95-3C15H15N5O4S
- N-(3,4-Dimethoxyphenyl)-2-((4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamide877629-96-4C15H15N5O4S
- 2-((4-Oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)-N-(2-(trifluoromethyl)phenyl)acetamide877629-99-7C14H10F3N5O2S
- 2-((4-Oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)-N-(3-(trifluoromethyl)phenyl)acetamide877630-00-7C14H10F3N5O2S
- 2-((4-Oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)-N-(4-(trifluoromethyl)phenyl)acetamide877630-01-8C14H10F3N5O2S
- 2-((4-Oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)-N-(4-(trifluoromethoxy)phenyl)acetamide877630-02-9C14H10F3N5O3S
- Ethyl 2-(2-((4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamido)benzoate877630-05-2C16H15N5O4S
- Ethyl 4-(2-((4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamido)benzoate877630-06-3C16H15N5O4S
- Methyl 4-(2-((4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamido)benzoate877630-07-4C15H13N5O4S
- N-(4-Acetylphenyl)-2-((4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamide877630-08-5C15H13N5O3S
- N-(3-Acetamidophenyl)-2-((4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamide877630-09-6C15H14N6O3S
- N-(4-Acetamidophenyl)-2-((4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamide877630-11-0C15H14N6O3S
- 4-(2-((4-Oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamido)benzamide877630-30-3C14H12N6O3S
- N-Methyl-2-((4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)-N-phenylacetamide877630-61-0C14H13N5O2S
- N-(3-Chlorophenyl)-2-((4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamide877630-63-2C13H10ClN5O2S
- N-(4-Chlorophenyl)-2-((4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamide877630-64-3C13H10ClN5O2S
- N-(4-Bromophenyl)-2-({4-oxo-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-6-yl}sulfanyl)acetamide877630-65-4C13H10BrN5O2S
- N-(3,4-Dichlorophenyl)-2-((4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamide877630-66-5C13H9Cl2N5O2S
- N-(3-Chloro-4-methylphenyl)-2-({4-oxo-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-6-yl}sulfanyl)acetamide877630-67-6C14H12ClN5O2S
- N-(5-Chloro-2-methoxyphenyl)-2-((4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamide877630-68-7C14H12ClN5O3S
- N-(2-Chloro-5-(trifluoromethyl)phenyl)-2-((4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)acetamide877630-69-8C14H9ClF3N5O2S
- 2-((1-(2-Hydroxyethyl)-4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)-N-(m-tolyl)acetamide946254-70-2C16H17N5O3S
Related scaffolds
Same ring framework with different atoms or bond orders
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