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Murcko scaffold

Ring system with 3 rings and 24 atoms

12 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
24
Chemicals
12
With full pages
5
Scaffold SMILES

O=C(CCN1C(=O)C(=Cc2ccccc2)SC1=S)N1CCNCC1

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=C(CCN1C(=O)C(=Cc2ccccc2)SC1=S)N1CCNCC1

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 12 of 12 chemicals

5-(4-Fluoro-benzylidene)-3-[3-(4-methyl-piperazin-1-yl)-3-oxo-propyl]-2-thioxo-thiazolidin-4-one chemical structure, C18H20FN3O2S2, CAS 307527-31-7
5-(4-Fluoro-benzylidene)-3-[3-(4-methyl-piperazin-1-yl)-3-oxo-propyl]-2-thioxo-thiazolidin-4-one
CAS 307527-31-7C18H20FN3O2S2
5-(2-Methoxy-benzylidene)-3-[3-(4-methyl-piperazin-1-yl)-3-oxo-propyl]-2-thioxo-thiazolidin-4-one chemical structure, C19H23N3O3S2, CAS 306323-19-3
5-(2-Methoxy-benzylidene)-3-[3-(4-methyl-piperazin-1-yl)-3-oxo-propyl]-2-thioxo-thiazolidin-4-one
CAS 306323-19-3C19H23N3O3S2
(5Z)-5-[(4-Methoxyphenyl)methylidene]-3-[3-(4-methylpiperazin-1-yl)-3-oxopropyl]-2-sulfanylidene-1,3-thiazolidin-4-one chemical structure, C19H23N3O3S2, CAS 303798-71-2
(5Z)-5-[(4-Methoxyphenyl)methylidene]-3-[3-(4-methylpiperazin-1-yl)-3-oxopropyl]-2-sulfanylidene-1,3-thiazolidin-4-one
CAS 303798-71-2C19H23N3O3S2
(5E)-5-(2,4-Dichlorobenzylidene)-3-[3-(4-methylpiperazin-1-yl)-3-oxopropyl]-2-thioxo-1,3-thiazolidin-4-one chemical structure, C18H19Cl2N3O2S2, CAS 303055-77-8
(5E)-5-(2,4-Dichlorobenzylidene)-3-[3-(4-methylpiperazin-1-yl)-3-oxopropyl]-2-thioxo-1,3-thiazolidin-4-one
CAS 303055-77-8C18H19Cl2N3O2S2
5-[(4-Methylphenyl)methylene]-3-[3-(4-methylpiperazinyl)-3-oxopropyl]-2-thioxo-1,3-thiazolidin-4-one chemical structure, C19H23N3O2S2, CAS 303055-76-7
5-[(4-Methylphenyl)methylene]-3-[3-(4-methylpiperazinyl)-3-oxopropyl]-2-thioxo-1,3-thiazolidin-4-one
CAS 303055-76-7C19H23N3O2S2
(5Z)-5-[(2-Chlorophenyl)methylidene]-3-[3-(4-methylpiperazin-1-yl)-3-oxopropyl]-2-sulfanylidene-1,3-thiazolidin-4-one chemical structure, C18H20ClN3O2S2, CAS 303055-83-6
(5Z)-5-[(2-Chlorophenyl)methylidene]-3-[3-(4-methylpiperazin-1-yl)-3-oxopropyl]-2-sulfanylidene-1,3-thiazolidin-4-one
CAS 303055-83-6C18H20ClN3O2S2
(5Z)-5-[(3,4-Dimethoxyphenyl)methylidene]-3-[3-(4-methylpiperazin-1-yl)-3-oxopropyl]-2-sulfanylidene-1,3-thiazolidin-4-one chemical structure, C20H25N3O4S2, CAS 403829-55-0
(5Z)-5-[(3,4-Dimethoxyphenyl)methylidene]-3-[3-(4-methylpiperazin-1-yl)-3-oxopropyl]-2-sulfanylidene-1,3-thiazolidin-4-one
CAS 403829-55-0C20H25N3O4S2
Ethyl 4-{3-[(5E)-5-[(4-methylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoyl}piperazine-1-carboxylate chemical structure, C21H25N3O4S2, CAS 381198-16-9
Ethyl 4-{3-[(5E)-5-[(4-methylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoyl}piperazine-1-carboxylate
CAS 381198-16-9C21H25N3O4S2
Ethyl 4-{3-[5-(2-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoyl}-1-piperazinecarboxylate chemical structure, C20H22ClN3O4S2, CAS 380871-05-6
Ethyl 4-{3-[5-(2-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoyl}-1-piperazinecarboxylate
CAS 380871-05-6C20H22ClN3O4S2
(E)-Ethyl 4-(3-(5-(3-bromobenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)propanoyl)piperazine-1-carboxylate chemical structure, C20H22BrN3O4S2, CAS 466677-50-9
(E)-Ethyl 4-(3-(5-(3-bromobenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)propanoyl)piperazine-1-carboxylate
CAS 466677-50-9C20H22BrN3O4S2
(5E)-5-[(2-Fluorophenyl)methylidene]-3-[3-(4-methylpiperazin-1-yl)-3-oxopropyl]-2-sulfanylidene-1,3-thiazolidin-4-one chemical structure, C18H20FN3O2S2, CAS 477488-41-8
(5E)-5-[(2-Fluorophenyl)methylidene]-3-[3-(4-methylpiperazin-1-yl)-3-oxopropyl]-2-sulfanylidene-1,3-thiazolidin-4-one
CAS 477488-41-8C18H20FN3O2S2
(E)-Ethyl 4-(3-(5-(2-fluorobenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)propanoyl)piperazine-1-carboxylate chemical structure, C20H22FN3O4S2, CAS 477488-44-1
(E)-Ethyl 4-(3-(5-(2-fluorobenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)propanoyl)piperazine-1-carboxylate
CAS 477488-44-1C20H22FN3O4S2