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Murcko scaffold

Ring system with 3 rings and 25 atoms

9 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
25
Chemicals
9
With full pages
2
Scaffold SMILES

O=C(CCCN1C(=O)C(=Cc2cccs2)SC1=S)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.

Substructure search with this scaffold
Murcko scaffold O=C(CCCN1C(=O)C(=Cc2cccs2)SC1=S)Nc1ccccc1

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 9 of 9 chemicals

N-(2-Hydroxyethyl)-4-[(5E)-4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]-N-phenylbutanamide chemical structure, C20H20N2O3S3, CAS 315244-59-8
N-(2-Hydroxyethyl)-4-[(5E)-4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]-N-phenylbutanamide
CAS 315244-59-8C20H20N2O3S3
N-(4-Acetylphenyl)-4-[(5E)-4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]butanamide chemical structure, C20H18N2O3S3, CAS 315244-66-7
N-(4-Acetylphenyl)-4-[(5E)-4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]butanamide
CAS 315244-66-7C20H18N2O3S3
N-(3-Methoxyphenyl)-4-[(5E)-4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]butanamide chemical structure, C19H18N2O3S3, CAS 315244-67-8
N-(3-Methoxyphenyl)-4-[(5E)-4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]butanamide
CAS 315244-67-8C19H18N2O3S3
3-[4-[(5E)-4-Oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]butanoylamino]benzoic acid chemical structure, C19H16N2O4S3, CAS 315244-68-9
3-[4-[(5E)-4-Oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]butanoylamino]benzoic acid
CAS 315244-68-9C19H16N2O4S3
4-[(5Z)-4-Oxo-5-(thiophen-2-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl]-N-phenylbutanamide chemical structure, C18H16N2O2S3, CAS 333443-05-3
4-[(5Z)-4-Oxo-5-(thiophen-2-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl]-N-phenylbutanamide
CAS 333443-05-3C18H16N2O2S3
(Z)-4-(4-Oxo-5-(thiophen-2-ylmethylene)-2-thioxothiazolidin-3-yl)-N-(3-(trifluoromethyl)phenyl)butanamide chemical structure, C19H15F3N2O2S3, CAS 380876-13-1
(Z)-4-(4-Oxo-5-(thiophen-2-ylmethylene)-2-thioxothiazolidin-3-yl)-N-(3-(trifluoromethyl)phenyl)butanamide
CAS 380876-13-1C19H15F3N2O2S3
N-(4-Hydroxyphenyl)-4-[(5Z)-4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]butanamide chemical structure, C18H16N2O3S3, CAS 356572-19-5
N-(4-Hydroxyphenyl)-4-[(5Z)-4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]butanamide
CAS 356572-19-5C18H16N2O3S3
(Z)-N-(2,3-Dimethylphenyl)-4-(4-oxo-5-(thiophen-2-ylmethylene)-2-thioxothiazolidin-3-yl)butanamide chemical structure, C20H20N2O2S3, CAS 333443-09-7
(Z)-N-(2,3-Dimethylphenyl)-4-(4-oxo-5-(thiophen-2-ylmethylene)-2-thioxothiazolidin-3-yl)butanamide
CAS 333443-09-7C20H20N2O2S3
(E)-2-(Diethylamino)ethyl 4-(4-(4-oxo-5-(thiophen-2-ylmethylene)-2-thioxothiazolidin-3-yl)butanamido)benzoate chemical structure, C25H29N3O4S3, CAS 425373-05-3
(E)-2-(Diethylamino)ethyl 4-(4-(4-oxo-5-(thiophen-2-ylmethylene)-2-thioxothiazolidin-3-yl)butanamido)benzoate
CAS 425373-05-3C25H29N3O4S3