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Murcko scaffold

Ring system with 4 rings and 29 atoms

7 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
29
Chemicals
7
With full pages
1
Scaffold SMILES

O=C(NCc1ccccc1)C1Cc2ccccc2CN1S(=O)(=O)c1ccccc1

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(NCc1ccccc1)C1Cc2ccccc2CN1S(=O)(=O)c1ccccc1

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 7 of 7 chemicals

N-Benzyl-2-(4-methoxyphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide chemical structure, C24H24N2O4S, CAS 459147-81-0
N-Benzyl-2-(4-methoxyphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide
CAS 459147-81-0C24H24N2O4S
N-Benzyl-2-((4-fluorophenyl)sulfonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide chemical structure, C23H21FN2O3S, CAS 1008487-75-9
N-Benzyl-2-((4-fluorophenyl)sulfonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
CAS 1008487-75-9C23H21FN2O3S
N-(4-Methoxybenzyl)-2-[(4-methylphenyl)sulfonyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide chemical structure, C25H26N2O4S, CAS 1009245-69-5
N-(4-Methoxybenzyl)-2-[(4-methylphenyl)sulfonyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
CAS 1009245-69-5C25H26N2O4S
N-Benzyl-2-[(4-methylphenyl)sulfonyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide chemical structure, C24H24N2O3S, CAS 1008695-00-8
N-Benzyl-2-[(4-methylphenyl)sulfonyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
CAS 1008695-00-8C24H24N2O3S
N-(4-Bromobenzyl)-2-[(4-methylphenyl)sulfonyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide chemical structure, C24H23BrN2O3S, CAS 497819-55-3
N-(4-Bromobenzyl)-2-[(4-methylphenyl)sulfonyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
CAS 497819-55-3C24H23BrN2O3S
N-[(2-Chlorophenyl)methyl]-2-(4-methylbenzenesulfonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide chemical structure, C24H23ClN2O3S, CAS 1008265-65-3
N-[(2-Chlorophenyl)methyl]-2-(4-methylbenzenesulfonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
CAS 1008265-65-3C24H23ClN2O3S
N-[(4-Chlorophenyl)methyl]-1,2,3,4-tetrahydro-2-[[4-(trifluoromethyl)phenyl]sulfonyl]-3-isoquinolinecarboxamide chemical structure, C24H20ClF3N2O3S, CAS 1219389-85-1
N-[(4-Chlorophenyl)methyl]-1,2,3,4-tetrahydro-2-[[4-(trifluoromethyl)phenyl]sulfonyl]-3-isoquinolinecarboxamide
CAS 1219389-85-1C24H20ClF3N2O3S