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Murcko scaffold

Ring system with 5 rings and 30 atoms

17 chemicals on CompoundList share this ring system.

Rings
5
Scaffold atoms
30
Chemicals
17
With full pages
10
Scaffold SMILES

O=C1C(=Cc2cn(-c3ccccc3)nc2-c2ccccc2)SC(=S)N1C1CCCC1

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=C1C(=Cc2cn(-c3ccccc3)nc2-c2ccccc2)SC(=S)N1C1CCCC1

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 17 of 17 chemicals

(5Z)-5-({3-[4-(Butylsulfanyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-3-cyclopentyl-2-thioxo-1,3-thiazolidin-4-one chemical structure, C28H29N3OS3, CAS 1008877-90-4
(5Z)-5-({3-[4-(Butylsulfanyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-3-cyclopentyl-2-thioxo-1,3-thiazolidin-4-one
CAS 1008877-90-4C28H29N3OS3
(5Z)-3-Cyclopentyl-5-({1-phenyl-3-[4-(propylsulfanyl)phenyl]-1H-pyrazol-4-yl}methylidene)-2-thioxo-1,3-thiazolidin-4-one chemical structure, C27H27N3OS3, CAS 1008880-10-1
(5Z)-3-Cyclopentyl-5-({1-phenyl-3-[4-(propylsulfanyl)phenyl]-1H-pyrazol-4-yl}methylidene)-2-thioxo-1,3-thiazolidin-4-one
CAS 1008880-10-1C27H27N3OS3
(5Z)-5-{[3-(3-Butoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-cyclopentyl-2-thioxo-1,3-thiazolidin-4-one chemical structure, C28H29N3O2S2, CAS 1008884-00-1
(5Z)-5-{[3-(3-Butoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-cyclopentyl-2-thioxo-1,3-thiazolidin-4-one
CAS 1008884-00-1C28H29N3O2S2
(5Z)-3-Cyclopentyl-5-{[3-(3-ethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-thioxo-1,3-thiazolidin-4-one chemical structure, C26H25N3O2S2, CAS 1009190-37-7
(5Z)-3-Cyclopentyl-5-{[3-(3-ethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-thioxo-1,3-thiazolidin-4-one
CAS 1009190-37-7C26H25N3O2S2
3-{4-[(Z)-(3-Cyclopentyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-1-phenyl-1H-pyrazol-3-yl}-N,N-dimethylbenzenesulfonamide chemical structure, C26H26N4O3S3, CAS 1001784-81-1
3-{4-[(Z)-(3-Cyclopentyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-1-phenyl-1H-pyrazol-3-yl}-N,N-dimethylbenzenesulfonamide
CAS 1001784-81-1C26H26N4O3S3
(5Z)-3-Cyclopentyl-5-((3-(4-isobutoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl)methylene)-2-thioxo-1,3-thiazolidin-4-one chemical structure, C29H31N3O2S2, CAS 624724-52-3
(5Z)-3-Cyclopentyl-5-((3-(4-isobutoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl)methylene)-2-thioxo-1,3-thiazolidin-4-one
CAS 624724-52-3C29H31N3O2S2
(5Z)-3-Cyclopentyl-5-{[3-(3-fluoro-4-propoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylene}-2-thioxo-1,3-thiazolidin-4-one chemical structure, C27H26FN3O2S2, CAS 623939-71-9
(5Z)-3-Cyclopentyl-5-{[3-(3-fluoro-4-propoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylene}-2-thioxo-1,3-thiazolidin-4-one
CAS 623939-71-9C27H26FN3O2S2
(5Z)-3-Cyclopentyl-5-{[3-(3-fluoro-4-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylene}-2-thioxo-1,3-thiazolidin-4-one chemical structure, C25H22FN3OS2, CAS 623939-76-4
(5Z)-3-Cyclopentyl-5-{[3-(3-fluoro-4-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylene}-2-thioxo-1,3-thiazolidin-4-one
CAS 623939-76-4C25H22FN3OS2
(5Z)-3-Cyclopentyl-5-((3-(4-fluorophenyl)-1-phenyl-1H-pyrazol-4-yl)methylene)-2-thioxo-1,3-thiazolidin-4-one chemical structure, C24H20FN3OS2, CAS 623935-64-8
(5Z)-3-Cyclopentyl-5-((3-(4-fluorophenyl)-1-phenyl-1H-pyrazol-4-yl)methylene)-2-thioxo-1,3-thiazolidin-4-one
CAS 623935-64-8C24H20FN3OS2
(5Z)-3-Cyclopentyl-5-{[1-phenyl-3-(3-propoxyphenyl)-1H-pyrazol-4-yl]methylidene}-2-thioxo-1,3-thiazolidin-4-one chemical structure, C27H27N3O2S2, CAS 1010869-69-8
(5Z)-3-Cyclopentyl-5-{[1-phenyl-3-(3-propoxyphenyl)-1H-pyrazol-4-yl]methylidene}-2-thioxo-1,3-thiazolidin-4-one
CAS 1010869-69-8C27H27N3O2S2
(5Z)-3-Cyclopentyl-5-{[3-(4-isobutoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylene}-2-thioxo-1,3-thiazolidin-4-one chemical structure, C28H29N3O2S2, CAS 624724-28-3
(5Z)-3-Cyclopentyl-5-{[3-(4-isobutoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylene}-2-thioxo-1,3-thiazolidin-4-one
CAS 624724-28-3C28H29N3O2S2
(5Z)-3-Cyclopentyl-5-({3-[4-(ethylsulfanyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-2-thioxo-1,3-thiazolidin-4-one chemical structure, C26H25N3OS3, CAS 1009185-79-8
(5Z)-3-Cyclopentyl-5-({3-[4-(ethylsulfanyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-2-thioxo-1,3-thiazolidin-4-one
CAS 1009185-79-8C26H25N3OS3
(5Z)-3-Cyclopentyl-5-[(1,3-diphenyl-1H-pyrazol-4-yl)methylene]-2-thioxo-1,3-thiazolidin-4-one chemical structure, C24H21N3OS2, CAS 623940-42-1
(5Z)-3-Cyclopentyl-5-[(1,3-diphenyl-1H-pyrazol-4-yl)methylene]-2-thioxo-1,3-thiazolidin-4-one
CAS 623940-42-1C24H21N3OS2
(5Z)-3-Cyclopentyl-5-((3-(3,4-dimethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl)methylene)-2-thioxo-1,3-thiazolidin-4-one chemical structure, C26H25N3O3S2, CAS 623935-90-0
(5Z)-3-Cyclopentyl-5-((3-(3,4-dimethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl)methylene)-2-thioxo-1,3-thiazolidin-4-one
CAS 623935-90-0C26H25N3O3S2
(5Z)-5-{[3-(4-Butoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylene}-3-cyclopentyl-2-thioxo-1,3-thiazolidin-4-one chemical structure, C29H31N3O2S2, CAS 623940-53-4
(5Z)-5-{[3-(4-Butoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylene}-3-cyclopentyl-2-thioxo-1,3-thiazolidin-4-one
CAS 623940-53-4C29H31N3O2S2
(5Z)-5-((3-(3-Chloro-4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl)methylene)-3-cyclopentyl-2-thioxo-1,3-thiazolidin-4-one chemical structure, C25H22ClN3O2S2, CAS 624724-35-2
(5Z)-5-((3-(3-Chloro-4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl)methylene)-3-cyclopentyl-2-thioxo-1,3-thiazolidin-4-one
CAS 624724-35-2C25H22ClN3O2S2
(5Z)-5-{[3-(4-Chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]methylene}-3-cyclopentyl-2-thioxo-1,3-thiazolidin-4-one chemical structure, C24H20ClN3OS2, CAS 623935-49-9
(5Z)-5-{[3-(4-Chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]methylene}-3-cyclopentyl-2-thioxo-1,3-thiazolidin-4-one
CAS 623935-49-9C24H20ClN3OS2