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Murcko scaffold

Ring system with 3 rings and 17 atoms

8 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
17
Chemicals
8
With full pages
4
Scaffold SMILES

O=C1CCCc2nccc(-c3ccccc3)c21

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=C1CCCc2nccc(-c3ccccc3)c21

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 8 of 8 chemicals

Ethyl 5,6,7,8-tetrahydro-2,7,7-trimethyl-5-oxo-4-phenyl-3-quinolinecarboxylate chemical structure, C21H23NO3, CAS 13337-65-0
Ethyl 5,6,7,8-tetrahydro-2,7,7-trimethyl-5-oxo-4-phenyl-3-quinolinecarboxylate
CAS 13337-65-0C21H23NO3
Ethyl 4-(4-bromophenyl)-2,7,7-trimethyl-5-oxo-5,6,7,8-tetrahydroquinoline-3-carboxylate chemical structure, C21H22BrNO3, CAS 307343-34-6
Ethyl 4-(4-bromophenyl)-2,7,7-trimethyl-5-oxo-5,6,7,8-tetrahydroquinoline-3-carboxylate
CAS 307343-34-6C21H22BrNO3
2-((3-Cyano-7,7-dimethyl-5-oxo-4-phenyl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl)acetamide chemical structure, C20H19N3O2S, CAS 670272-87-4
2-((3-Cyano-7,7-dimethyl-5-oxo-4-phenyl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl)acetamide
CAS 670272-87-4C20H19N3O2S
Ethyl 4-(4-methoxyphenyl)-2,7,7-trimethyl-5-oxo-5,6,7,8-tetrahydro-3-quinolinecarboxylate chemical structure, C22H25NO4, CAS 316365-47-6
Ethyl 4-(4-methoxyphenyl)-2,7,7-trimethyl-5-oxo-5,6,7,8-tetrahydro-3-quinolinecarboxylate
CAS 316365-47-6C22H25NO4
2-[[3-Cyano-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-6,8-dihydroquinolin-2-yl]sulfanyl]acetamide chemical structure, C21H21N3O3S, CAS 667913-22-6
2-[[3-Cyano-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-6,8-dihydroquinolin-2-yl]sulfanyl]acetamide
CAS 667913-22-6C21H21N3O3S
4-(4-Bromophenyl)-7,7-dimethyl-5-oxo-2-prop-2-enylsulfanyl-6,8-dihydroquinoline-3-carbonitrile chemical structure, C21H19BrN2OS, CAS 137303-44-7
4-(4-Bromophenyl)-7,7-dimethyl-5-oxo-2-prop-2-enylsulfanyl-6,8-dihydroquinoline-3-carbonitrile
CAS 137303-44-7C21H19BrN2OS
7,7-Dimethyl-2-(methylthio)-5-oxo-4-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile chemical structure, C19H18N2OS, CAS 325745-32-2
7,7-Dimethyl-2-(methylthio)-5-oxo-4-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile
CAS 325745-32-2C19H18N2OS
Ethyl 2-methyl-5-oxo-4-phenyl-5,6,7,8-tetrahydro-3-quinolinecarboxylate chemical structure, C19H19NO3, CAS 154405-24-0
Ethyl 2-methyl-5-oxo-4-phenyl-5,6,7,8-tetrahydro-3-quinolinecarboxylate
CAS 154405-24-0C19H19NO3