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Murcko scaffold

Ring system with 4 rings and 24 atoms

20 chemicals on CompoundList share this ring system.

Rings: 4
Scaffold atoms: 24
Chemicals: 20
With full pages: 3

Scaffold SMILES

O=c1[nH]c(SCc2ccccc2)nc2c1cnn2-c1ccccc1

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.

Substructure search with this scaffold

Murcko scaffold O=c1[nH]c(SCc2ccccc2)nc2c1cnn2-c1ccccc1

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 20 of 20 chemicals

5-Amino-6-benzylsulfanyl-1-phenylpyrazolo[3,4-d]pyrimidin-4-one chemical structure, C18H15N5OS, CAS 667909-56-0

5-Amino-6-benzylsulfanyl-1-phenylpyrazolo[3,4-d]pyrimidin-4-one

CAS 667909-56-0C₁₈H₁₅N₅OS

1-(3,4-Dimethylphenyl)-6-((4-nitrobenzyl)thio)-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one chemical structure, C20H17N5O3S, CAS 851125-13-8

1-(3,4-Dimethylphenyl)-6-((4-nitrobenzyl)thio)-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one

CAS 851125-13-8C₂₀H₁₇N₅O₃S

1-(4-Chlorophenyl)-6-((3-nitrobenzyl)thio)-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one chemical structure, C18H12ClN5O3S, CAS 921501-81-7

1-(4-Chlorophenyl)-6-((3-nitrobenzyl)thio)-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one

CAS 921501-81-7C₁₈H₁₂ClN₅O₃S

6-((2-Fluorobenzyl)thio)-1-(4-fluorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one chemical structure, C18H12F2N4OS, CAS 534593-97-0

6-((2-Fluorobenzyl)thio)-1-(4-fluorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one

CAS 534593-97-0C₁₈H₁₂F₂N₄OS

1-(4-Fluorophenyl)-6-[(4-fluorophenyl)methylsulfanyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one chemical structure, C18H12F2N4OS, CAS 534591-61-2

1-(4-Fluorophenyl)-6-[(4-fluorophenyl)methylsulfanyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one

CAS 534591-61-2C₁₈H₁₂F₂N₄OS

6-((2,5-Dimethylbenzyl)thio)-1-(3,4-dimethylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one chemical structure, C22H22N4OS, CAS 851125-39-8

6-((2,5-Dimethylbenzyl)thio)-1-(3,4-dimethylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one

CAS 851125-39-8C₂₂H₂₂N₄OS

6-((2-Chlorobenzyl)thio)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one chemical structure, C18H13ClN4OS, CAS 850911-64-7

6-((2-Chlorobenzyl)thio)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one

CAS 850911-64-7C₁₈H₁₃ClN₄OS

6-((3,4-Dichlorobenzyl)thio)-1-(p-tolyl)-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one chemical structure, C19H14Cl2N4OS, CAS 851124-89-5

6-((3,4-Dichlorobenzyl)thio)-1-(p-tolyl)-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one

CAS 851124-89-5C₁₉H₁₄Cl₂N₄OS

6-((3,5-Dimethoxybenzyl)thio)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one chemical structure, C20H18N4O3S, CAS 1005307-11-8

6-((3,5-Dimethoxybenzyl)thio)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one

CAS 1005307-11-8C₂₀H₁₈N₄O₃S

1-(4-Chlorophenyl)-6-((3,5-dimethoxybenzyl)thio)-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one chemical structure, C20H17ClN4O3S, CAS 1005293-63-9

1-(4-Chlorophenyl)-6-((3,5-dimethoxybenzyl)thio)-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one

CAS 1005293-63-9C₂₀H₁₇ClN₄O₃S

Methyl 4-(((1-(4-chlorophenyl)-4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)methyl)benzoate chemical structure, C20H15ClN4O3S, CAS 1005307-23-2

Methyl 4-(((1-(4-chlorophenyl)-4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)methyl)benzoate

CAS 1005307-23-2C₂₀H₁₅ClN₄O₃S

6-((4-Bromobenzyl)thio)-1-(2-methoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one chemical structure, C19H15BrN4O2S, CAS 1005293-74-2

6-((4-Bromobenzyl)thio)-1-(2-methoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one

CAS 1005293-74-2C₁₉H₁₅BrN₄O₂S

6-((4-Chlorobenzyl)thio)-1-(2-methoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one chemical structure, C19H15ClN4O2S, CAS 1005293-76-4

6-((4-Chlorobenzyl)thio)-1-(2-methoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one

CAS 1005293-76-4C₁₉H₁₅ClN₄O₂S

1-(2-Methoxyphenyl)-6-((3-methylbenzyl)thio)-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one chemical structure, C20H18N4O2S, CAS 1005293-78-6

1-(2-Methoxyphenyl)-6-((3-methylbenzyl)thio)-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one

CAS 1005293-78-6C₂₀H₁₈N₄O₂S

1-(2-Methoxyphenyl)-6-((4-methylbenzyl)thio)-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one chemical structure, C20H18N4O2S, CAS 1005307-44-7

1-(2-Methoxyphenyl)-6-((4-methylbenzyl)thio)-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one

CAS 1005307-44-7C₂₀H₁₈N₄O₂S

1-(2-Methoxyphenyl)-6-((4-(trifluoromethyl)benzyl)thio)-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one chemical structure, C20H15F3N4O2S, CAS 921502-20-7

1-(2-Methoxyphenyl)-6-((4-(trifluoromethyl)benzyl)thio)-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one

CAS 921502-20-7C₂₀H₁₅F₃N₄O₂S

Methyl 4-(((1-(2-methoxyphenyl)-4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)methyl)benzoate chemical structure, C21H18N4O4S, CAS 921475-93-6

Methyl 4-(((1-(2-methoxyphenyl)-4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)thio)methyl)benzoate

CAS 921475-93-6C₂₁H₁₈N₄O₄S

1-(3-Chlorophenyl)-6-((3-fluorobenzyl)thio)-1H-pyrazolo[3,4-d]pyrimidin-4-ol chemical structure, C18H12ClFN4OS, CAS 922050-43-9

1-(3-Chlorophenyl)-6-((3-fluorobenzyl)thio)-1H-pyrazolo[3,4-d]pyrimidin-4-ol

CAS 922050-43-9C₁₈H₁₂ClFN₄OS

6-((2,4-Dichlorobenzyl)thio)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one chemical structure, C18H12Cl2N4OS, CAS 921486-46-6

6-((2,4-Dichlorobenzyl)thio)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one

CAS 921486-46-6C₁₈H₁₂Cl₂N₄OS

1-(2-Methoxyphenyl)-6-((1-phenylethyl)thio)-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one chemical structure, C20H18N4O2S, CAS 921475-69-6

1-(2-Methoxyphenyl)-6-((1-phenylethyl)thio)-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one

CAS 921475-69-6C₂₀H₁₈N₄O₂S