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Murcko scaffold

Ring system with 5 rings and 35 atoms

10 chemicals on CompoundList share this ring system.

Rings
5
Scaffold atoms
35
Chemicals
10
With full pages
7
Scaffold SMILES

O=C(CN1C(=O)C(=C2SC(=S)N(CCc3ccccc3)C2=O)c2ccccc21)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(CN1C(=O)C(=C2SC(=S)N(CCc3ccccc3)C2=O)c2ccccc21)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 10 of 10 chemicals

2-{(3Z)-2-Oxo-3-[4-oxo-3-(2-phenylethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]-2,3-dihydro-1H-indol-1-yl}-N-phenylacetamide chemical structure, C27H21N3O3S2, CAS 378761-30-9
2-{(3Z)-2-Oxo-3-[4-oxo-3-(2-phenylethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]-2,3-dihydro-1H-indol-1-yl}-N-phenylacetamide
CAS 378761-30-9C27H21N3O3S2
N-(4-Methylphenyl)-2-{(3Z)-2-oxo-3-[4-oxo-3-(2-phenylethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]-2,3-dihydro-1H-indol-1-yl}acetamide chemical structure, C28H23N3O3S2, CAS 381717-59-5
N-(4-Methylphenyl)-2-{(3Z)-2-oxo-3-[4-oxo-3-(2-phenylethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]-2,3-dihydro-1H-indol-1-yl}acetamide
CAS 381717-59-5C28H23N3O3S2
N-(3-Bromophenyl)-2-((3Z)-2-oxo-3-(4-oxo-3-(2-phenylethyl)-2-thioxo-1,3-thiazolidin-5-ylidene)-2,3-dihydro-1H-indol-1-yl)acetamide chemical structure, C27H20BrN3O3S2, CAS 618075-29-9
N-(3-Bromophenyl)-2-((3Z)-2-oxo-3-(4-oxo-3-(2-phenylethyl)-2-thioxo-1,3-thiazolidin-5-ylidene)-2,3-dihydro-1H-indol-1-yl)acetamide
CAS 618075-29-9C27H20BrN3O3S2
N-(3,4-Dimethylphenyl)-2-{(3Z)-2-oxo-3-[4-oxo-3-(2-phenylethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]-2,3-dihydro-1H-indol-1-YL}acetamide chemical structure, C29H25N3O3S2, CAS 618075-86-8
N-(3,4-Dimethylphenyl)-2-{(3Z)-2-oxo-3-[4-oxo-3-(2-phenylethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]-2,3-dihydro-1H-indol-1-YL}acetamide
CAS 618075-86-8C29H25N3O3S2
N-(2,6-Dimethylphenyl)-2-((3Z)-2-oxo-3-(4-oxo-3-(2-phenylethyl)-2-thioxo-1,3-thiazolidin-5-ylidene)-2,3-dihydro-1H-indol-1-yl)acetamide chemical structure, C29H25N3O3S2, CAS 618079-61-1
N-(2,6-Dimethylphenyl)-2-((3Z)-2-oxo-3-(4-oxo-3-(2-phenylethyl)-2-thioxo-1,3-thiazolidin-5-ylidene)-2,3-dihydro-1H-indol-1-yl)acetamide
CAS 618079-61-1C29H25N3O3S2
N-(2-Methylphenyl)-2-((3Z)-2-oxo-3-(4-oxo-3-(2-phenylethyl)-2-thioxo-1,3-thiazolidin-5-ylidene)-2,3-dihydro-1H-indol-1-yl)acetamide chemical structure, C28H23N3O3S2, CAS 618072-94-9
N-(2-Methylphenyl)-2-((3Z)-2-oxo-3-(4-oxo-3-(2-phenylethyl)-2-thioxo-1,3-thiazolidin-5-ylidene)-2,3-dihydro-1H-indol-1-yl)acetamide
CAS 618072-94-9C28H23N3O3S2
N-(2-Chlorophenyl)-2-((3Z)-2-oxo-3-(4-oxo-3-(2-phenylethyl)-2-thioxo-1,3-thiazolidin-5-ylidene)-2,3-dihydro-1H-indol-1-yl)acetamide chemical structure, C27H20ClN3O3S2, CAS 618077-11-5
N-(2-Chlorophenyl)-2-((3Z)-2-oxo-3-(4-oxo-3-(2-phenylethyl)-2-thioxo-1,3-thiazolidin-5-ylidene)-2,3-dihydro-1H-indol-1-yl)acetamide
CAS 618077-11-5C27H20ClN3O3S2
Ethyl 4-{[((3Z)-3-{3-[2-(4-methoxyphenyl)ethyl]-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene}-2-oxo-2,3-dihydro-1H-indol-1-yl)acetyl]amino}benzoate chemical structure, C31H27N3O6S2, CAS 617696-59-0
Ethyl 4-{[((3Z)-3-{3-[2-(4-methoxyphenyl)ethyl]-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene}-2-oxo-2,3-dihydro-1H-indol-1-yl)acetyl]amino}benzoate
CAS 617696-59-0C31H27N3O6S2
N-(2-Chlorophenyl)-2-((3Z)-3-{3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene}-2-oxo-2,3-dihydro-1H-indol-1-yl)acetamide chemical structure, C29H24ClN3O5S2, CAS 618077-25-1
N-(2-Chlorophenyl)-2-((3Z)-3-{3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene}-2-oxo-2,3-dihydro-1H-indol-1-yl)acetamide
CAS 618077-25-1C29H24ClN3O5S2
N-(2,5-Dimethylphenyl)-2-((3Z)-2-oxo-3-(4-oxo-3-(2-phenylethyl)-2-thioxo-1,3-thiazolidin-5-ylidene)-2,3-dihydro-1H-indol-1-yl)acetamide chemical structure, C29H25N3O3S2, CAS 618071-85-5
N-(2,5-Dimethylphenyl)-2-((3Z)-2-oxo-3-(4-oxo-3-(2-phenylethyl)-2-thioxo-1,3-thiazolidin-5-ylidene)-2,3-dihydro-1H-indol-1-yl)acetamide
CAS 618071-85-5C29H25N3O3S2