Murcko scaffold
Ring system with 2 rings and 16 atoms
44 chemicals on CompoundList share this ring system.
- Rings
- 2
- Scaffold atoms
- 16
- Chemicals
- 44
- With full pages
- 4
Scaffold SMILES
c1ccc(CNCCSc2nnn[nH]2)cc1
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 c1ccc(CNCCSc2nnn[nH]2)cc1](/scaffold/LOIIITXPHRSSDC-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 44 of 44 chemicals
![N-[(3-Methoxyphenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine chemical structure, C12H17N5OS, CAS 774553-15-0](/s/SMTXHKNNIPKXJY-UHFFFAOYSA-N.svg)
N-[(3-Methoxyphenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine
CAS 774553-15-0C12H17N5OS
![N-[(5-Bromo-2-methoxyphenyl)methyl]-2-[(1-methyl-5-tetrazolyl)thio]ethanamine chemical structure, C12H16BrN5OS, CAS 880814-35-7](/s/MWVFSBOSJAKLQG-UHFFFAOYSA-N.svg)
N-[(5-Bromo-2-methoxyphenyl)methyl]-2-[(1-methyl-5-tetrazolyl)thio]ethanamine
CAS 880814-35-7C12H16BrN5OS
![N-[(4-Methoxyphenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine chemical structure, C12H17N5OS, CAS 774556-19-3](/s/LCIYGVCSGGUUQR-UHFFFAOYSA-N.svg)
N-[(4-Methoxyphenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine
CAS 774556-19-3C12H17N5OS
![N-[(4-Ethylphenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine chemical structure, C13H19N5S, CAS 774554-95-9](/s/ZLVVKMFQJUSCRQ-UHFFFAOYSA-N.svg)
N-[(4-Ethylphenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine
CAS 774554-95-9C13H19N5S
![2-(1-Methyltetrazol-5-yl)sulfanyl-N-[(3-prop-2-enoxyphenyl)methyl]ethanamine chemical structure, C14H19N5OS, CAS 774553-11-6](/s/VYQVUXLVZLGHPI-UHFFFAOYSA-N.svg)
2-(1-Methyltetrazol-5-yl)sulfanyl-N-[(3-prop-2-enoxyphenyl)methyl]ethanamine
CAS 774553-11-6C14H19N5OS
![N-[(3-Ethoxyphenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine chemical structure, C13H19N5OS, CAS 774553-17-2](/s/LBVIGGKNGVUACW-UHFFFAOYSA-N.svg)
N-[(3-Ethoxyphenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine
CAS 774553-17-2C13H19N5OS
N-Benzyl-2-(1-methyltetrazol-5-yl)sulfanylethanamine
CAS 774555-89-4C11H15N5S
![N-[(4-Methylphenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine chemical structure, C12H17N5S, CAS 774555-91-8](/s/OUANNIFAYASYMS-UHFFFAOYSA-N.svg)
N-[(4-Methylphenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine
CAS 774555-91-8C12H17N5S
![N-[(3,4-Dimethoxyphenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine chemical structure, C13H19N5O2S, CAS 774551-42-7](/s/ZNXJEHIUULJWGX-UHFFFAOYSA-N.svg)
N-[(3,4-Dimethoxyphenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine
CAS 774551-42-7C13H19N5O2S
![N-[(2-Fluorophenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine chemical structure, C11H14FN5S, CAS 880808-96-8](/s/DMUFQNBXNRRSKO-UHFFFAOYSA-N.svg)
N-[(2-Fluorophenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine
CAS 880808-96-8C11H14FN5S
![N-[(4-Chlorophenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine chemical structure, C11H14ClN5S, CAS 774551-40-5](/s/BRUKTCLRAQJSAW-UHFFFAOYSA-N.svg)
N-[(4-Chlorophenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine
CAS 774551-40-5C11H14ClN5S
![N-[(4-Methylsulfanylphenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine chemical structure, C12H17N5S2, CAS 880073-17-6](/s/ZKNOYIUPIAJWSJ-UHFFFAOYSA-N.svg)
N-[(4-Methylsulfanylphenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine
CAS 880073-17-6C12H17N5S2
![N-(3-Bromo-4,5-dimethoxybenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine chemical structure, C13H18BrN5O2S, CAS 880808-42-4](/s/XLDWDBZREUDBDG-UHFFFAOYSA-N.svg)
N-(3-Bromo-4,5-dimethoxybenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine
CAS 880808-42-4C13H18BrN5O2S
![N-(3-Chloro-4,5-diethoxybenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine chemical structure, C15H22ClN5O2S, CAS 880808-22-0](/s/GILQMTRDFPSBRO-UHFFFAOYSA-N.svg)
N-(3-Chloro-4,5-diethoxybenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine
CAS 880808-22-0C15H22ClN5O2S
![N-[(3,4-Diethoxyphenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine chemical structure, C15H23N5O2S, CAS 880808-25-3](/s/JQWDILUFLGYBLU-UHFFFAOYSA-N.svg)
N-[(3,4-Diethoxyphenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine
CAS 880808-25-3C15H23N5O2S
![N-[(2,4-Dichlorophenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine chemical structure, C11H13Cl2N5S, CAS 880068-82-6](/s/FUMSYMBOHPPOAK-UHFFFAOYSA-N.svg)
N-[(2,4-Dichlorophenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine
CAS 880068-82-6C11H13Cl2N5S
![2-(1-Methyltetrazol-5-yl)sulfanyl-N-[[2-(trifluoromethyl)phenyl]methyl]ethanamine chemical structure, C12H14F3N5S, CAS 847467-70-3](/s/ZWLQNZHLZYEOED-UHFFFAOYSA-N.svg)
2-(1-Methyltetrazol-5-yl)sulfanyl-N-[[2-(trifluoromethyl)phenyl]methyl]ethanamine
CAS 847467-70-3C12H14F3N5S
![N-[(2-Chloro-6-fluorophenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine chemical structure, C11H13ClFN5S, CAS 880069-48-7](/s/QSUMERMGRCJWCG-UHFFFAOYSA-N.svg)
N-[(2-Chloro-6-fluorophenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine
CAS 880069-48-7C11H13ClFN5S
![N-[(3-Chloro-5-ethoxy-4-methoxyphenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine chemical structure, C14H20ClN5O2S, CAS 880808-30-0](/s/WCXQCOJBAKHXBV-UHFFFAOYSA-N.svg)
N-[(3-Chloro-5-ethoxy-4-methoxyphenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine
CAS 880808-30-0C14H20ClN5O2S
![N-(3-Chloro-4-ethoxy-5-methoxybenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine chemical structure, C14H20ClN5O2S, CAS 880808-03-7](/s/CSCRASCSXGAUKU-UHFFFAOYSA-N.svg)
N-(3-Chloro-4-ethoxy-5-methoxybenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine
CAS 880808-03-7C14H20ClN5O2S
![N-[(2,6-Dichlorophenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine chemical structure, C11H13Cl2N5S, CAS 880068-90-6](/s/XYEKBAKLEULFDL-UHFFFAOYSA-N.svg)
N-[(2,6-Dichlorophenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine
CAS 880068-90-6C11H13Cl2N5S
![N-[(2,4-Dimethoxyphenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine chemical structure, C13H19N5O2S, CAS 880068-67-7](/s/JKURLZLQMGIBFW-UHFFFAOYSA-N.svg)
N-[(2,4-Dimethoxyphenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine
CAS 880068-67-7C13H19N5O2S
![N,N-Diethyl-4-[[2-(1-methyltetrazol-5-yl)sulfanylethylamino]methyl]aniline chemical structure, C15H24N6S, CAS 875005-83-7](/s/DPEMFSMWFBGNIM-UHFFFAOYSA-N.svg)
N,N-Diethyl-4-[[2-(1-methyltetrazol-5-yl)sulfanylethylamino]methyl]aniline
CAS 875005-83-7C15H24N6S
![N-[(4-Bromophenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine chemical structure, C11H14BrN5S, CAS 880805-43-6](/s/NZRBDLCVIPFIPD-UHFFFAOYSA-N.svg)
N-[(4-Bromophenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine
CAS 880805-43-6C11H14BrN5S
- N-(4-Fluorobenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine880805-46-9C11H14FN5S
- N-[(2-Methoxyphenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine880805-86-7C12H17N5OS
- N-(3-Bromobenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine893597-74-5C11H14BrN5S
- N-[(4-Ethoxyphenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine880806-20-2C13H19N5OS
- N-[(2-Ethoxyphenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine880806-45-1C13H19N5OS
- N-(5-Chloro-2-ethoxybenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine880807-75-0C13H18ClN5OS
- N-(5-Bromo-2-ethoxybenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine880807-78-3C13H18BrN5OS
- N-(2-Ethoxy-3-methoxybenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine880807-83-0C14H21N5O2S
- N-(4-Ethoxy-3-methoxybenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine880807-94-3C14H21N5O2S
- N-(3-Ethoxy-4-methoxybenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine893614-94-3C14H21N5O2S
- N-[(3,5-Dichloro-2-methoxyphenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine880808-79-7C12H15Cl2N5OS
- N-[(3,5-Dichloro-2-ethoxyphenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine880808-82-2C13H17Cl2N5OS
- N-[(2-Chlorophenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine880808-85-5C11H14ClN5S
- N-[(3-Chlorophenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine880808-88-8C11H14ClN5S
- N-(2,3-Dichlorobenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine880808-91-3C11H13Cl2N5S
- N-(2-Methylbenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine880808-98-0C12H17N5S
- N-(5-Chloro-2-methoxybenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine880813-00-3C12H16ClN5OS
- 2-(1-Methyltetrazol-5-yl)sulfanyl-N-[(4-propan-2-ylphenyl)methyl]ethanamine880813-01-4C14H21N5S
- N,N-Diethyl-4-(((2-((1-methyl-1H-tetrazol-5-yl)thio)ethyl)amino)methyl)aniline hydrochloride1046451-40-4C15H25ClN6S
- N-(3-Chloro-4-ethoxybenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine940354-24-5C13H18ClN5OS
Related scaffolds
Same ring framework with different atoms or bond orders
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O=C(COc1ccccc1)NCC1CCCO117 chemicals
S=C(NCCc1ccccc1)Nc1nccs116 chemicals
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O=C(Cn1cccn1)NN=Cc1ccccc112 chemicals
O=C(NCC1CCCO1)C(=O)Nc1ccccc112 chemicals![Scaffold O=C(Cc1ccc[nH]1)NN=Cc1ccccc1](/scaffold/XCXHYNVYLRCCIP-UHFFFAOYSA-N/structure.svg)
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O=C(NNC(=S)Nc1ccccc1)c1cc[nH]n111 chemicals