CompoundList
Sign in
Murcko scaffold

Ring system with 3 rings and 20 atoms

22 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
20
Chemicals
22
With full pages
4
Scaffold SMILES

O=C(Nc1ccccc1)C1=CNC=CC1c1ccco1

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(Nc1ccccc1)C1=CNC=CC1c1ccco1

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 22 of 22 chemicals

5-Cyano-4-(furan-2-yl)-2-methyl-6-(methylthio)-N-(o-tolyl)-1,4-dihydropyridine-3-carboxamide chemical structure, C20H19N3O2S, CAS 375835-69-1
5-Cyano-4-(furan-2-yl)-2-methyl-6-(methylthio)-N-(o-tolyl)-1,4-dihydropyridine-3-carboxamide
CAS 375835-69-1C20H19N3O2S
Isopropyl 2-((3-cyano-4-(furan-2-yl)-6-methyl-5-(phenylcarbamoyl)-1,4-dihydropyridin-2-yl)thio)acetate chemical structure, C23H23N3O4S, CAS 223110-97-2
Isopropyl 2-((3-cyano-4-(furan-2-yl)-6-methyl-5-(phenylcarbamoyl)-1,4-dihydropyridin-2-yl)thio)acetate
CAS 223110-97-2C23H23N3O4S
5-Cyano-4-(furan-2-yl)-2-methyl-N-phenyl-6-(propylsulfanyl)-1,4-dihydropyridine-3-carboxamide chemical structure, C21H21N3O2S, CAS 223110-19-8
5-Cyano-4-(furan-2-yl)-2-methyl-N-phenyl-6-(propylsulfanyl)-1,4-dihydropyridine-3-carboxamide
CAS 223110-19-8C21H21N3O2S
Methyl 2-[[3-cyano-6-methyl-4-(5-methylfuran-2-yl)-5-(phenylcarbamoyl)-1,4-dihydropyridin-2-yl]sulfanyl]acetate chemical structure, C22H21N3O4S, CAS 415688-15-2
Methyl 2-[[3-cyano-6-methyl-4-(5-methylfuran-2-yl)-5-(phenylcarbamoyl)-1,4-dihydropyridin-2-yl]sulfanyl]acetate
CAS 415688-15-2C22H21N3O4S
6-(2-Amino-2-oxoethyl)sulfanyl-5-cyano-4-(furan-2-yl)-N-(2-methoxyphenyl)-2-methyl-1,4-dihydropyridine-3-carboxamide chemical structure, C21H20N4O4S, CAS 207003-77-8
6-(2-Amino-2-oxoethyl)sulfanyl-5-cyano-4-(furan-2-yl)-N-(2-methoxyphenyl)-2-methyl-1,4-dihydropyridine-3-carboxamide
CAS 207003-77-8C21H20N4O4S
5-Cyano-4-(furan-2-yl)-N-(2-methoxyphenyl)-2-methyl-6-(methylsulfanyl)-1,4-dihydropyridine-3-carboxamide chemical structure, C20H19N3O3S, CAS 207003-78-9
5-Cyano-4-(furan-2-yl)-N-(2-methoxyphenyl)-2-methyl-6-(methylsulfanyl)-1,4-dihydropyridine-3-carboxamide
CAS 207003-78-9C20H19N3O3S
5-Cyano-4-(furan-2-yl)-N-(2-methoxyphenyl)-2-methyl-6-(prop-2-en-1-ylsulfanyl)-1,4-dihydropyridine-3-carboxamide chemical structure, C22H21N3O3S, CAS 5915-39-9
5-Cyano-4-(furan-2-yl)-N-(2-methoxyphenyl)-2-methyl-6-(prop-2-en-1-ylsulfanyl)-1,4-dihydropyridine-3-carboxamide
CAS 5915-39-9C22H21N3O3S
6-(2-Amino-2-oxoethyl)sulfanyl-N-(4-chlorophenyl)-5-cyano-4-(furan-2-yl)-2-methyl-1,4-dihydropyridine-3-carboxamide chemical structure, C20H17ClN4O3S, CAS 375351-69-2
6-(2-Amino-2-oxoethyl)sulfanyl-N-(4-chlorophenyl)-5-cyano-4-(furan-2-yl)-2-methyl-1,4-dihydropyridine-3-carboxamide
CAS 375351-69-2C20H17ClN4O3S
Ethyl {[3-cyano-4-(2-furyl)-6-methyl-5-({[3-(trifluoromethyl)phenyl]amino}carbonyl)-1,4-dihydro-2-pyridinyl]thio}acetate chemical structure, C23H20F3N3O4S, CAS 692775-10-3
Ethyl {[3-cyano-4-(2-furyl)-6-methyl-5-({[3-(trifluoromethyl)phenyl]amino}carbonyl)-1,4-dihydro-2-pyridinyl]thio}acetate
CAS 692775-10-3C23H20F3N3O4S
6-((2-(tert-Butylamino)-2-oxoethyl)thio)-5-cyano-N-(4-fluorophenyl)-4-(furan-2-yl)-2-methyl-1,4-dihydropyridine-3-carboxamide chemical structure, C24H25FN4O3S, CAS 693230-27-2
6-((2-(tert-Butylamino)-2-oxoethyl)thio)-5-cyano-N-(4-fluorophenyl)-4-(furan-2-yl)-2-methyl-1,4-dihydropyridine-3-carboxamide
CAS 693230-27-2C24H25FN4O3S
Ethyl 2-({3-cyano-5-[(2-fluorophenyl)carbamoyl]-4-(furan-2-yl)-6-methyl-1,4-dihydropyridin-2-YL}sulfanyl)acetate chemical structure, C22H20FN3O4S, CAS 693237-26-2
Ethyl 2-({3-cyano-5-[(2-fluorophenyl)carbamoyl]-4-(furan-2-yl)-6-methyl-1,4-dihydropyridin-2-YL}sulfanyl)acetate
CAS 693237-26-2C22H20FN3O4S
6-(2-Amino-2-oxoethyl)sulfanyl-N-[2-chloro-5-(trifluoromethyl)phenyl]-5-cyano-4-(furan-2-yl)-2-methyl-1,4-dihydropyridine-3-carboxamide chemical structure, C21H16ClF3N4O3S, CAS 701242-14-0
6-(2-Amino-2-oxoethyl)sulfanyl-N-[2-chloro-5-(trifluoromethyl)phenyl]-5-cyano-4-(furan-2-yl)-2-methyl-1,4-dihydropyridine-3-carboxamide
CAS 701242-14-0C21H16ClF3N4O3S
Methyl 2-{[3-cyano-4-(furan-2-yl)-6-methyl-5-(phenylcarbamoyl)-1,4-dihydropyridin-2-yl]sulfanyl}acetate chemical structure, C21H19N3O4S, CAS 223110-41-6
Methyl 2-{[3-cyano-4-(furan-2-yl)-6-methyl-5-(phenylcarbamoyl)-1,4-dihydropyridin-2-yl]sulfanyl}acetate
CAS 223110-41-6C21H19N3O4S
Ethyl {[3-cyano-4-(furan-2-yl)-6-methyl-5-(phenylcarbamoyl)-1,4-dihydropyridin-2-yl]sulfanyl}acetate chemical structure, C22H21N3O4S, CAS 223109-58-8
Ethyl {[3-cyano-4-(furan-2-yl)-6-methyl-5-(phenylcarbamoyl)-1,4-dihydropyridin-2-yl]sulfanyl}acetate
CAS 223109-58-8C22H21N3O4S
Methyl 2-({5-[(4-chlorophenyl)carbamoyl]-3-cyano-4-(furan-2-yl)-6-methyl-1,4-dihydropyridin-2-YL}sulfanyl)acetate chemical structure, C21H18ClN3O4S, CAS 375836-15-0
Methyl 2-({5-[(4-chlorophenyl)carbamoyl]-3-cyano-4-(furan-2-yl)-6-methyl-1,4-dihydropyridin-2-YL}sulfanyl)acetate
CAS 375836-15-0C21H18ClN3O4S
6-((2-Amino-2-oxoethyl)thio)-5-cyano-N-(2-fluorophenyl)-4-(furan-2-yl)-2-methyl-1,4-dihydropyridine-3-carboxamide chemical structure, C20H17FN4O3S, CAS 796877-99-1
6-((2-Amino-2-oxoethyl)thio)-5-cyano-N-(2-fluorophenyl)-4-(furan-2-yl)-2-methyl-1,4-dihydropyridine-3-carboxamide
CAS 796877-99-1C20H17FN4O3S
5-Cyano-4-(furan-2-yl)-N-(2-methoxyphenyl)-2-methyl-6-(propylsulfanyl)-1,4-dihydropyridine-3-carboxamide chemical structure, C22H23N3O3S, CAS 207003-74-5
5-Cyano-4-(furan-2-yl)-N-(2-methoxyphenyl)-2-methyl-6-(propylsulfanyl)-1,4-dihydropyridine-3-carboxamide
CAS 207003-74-5C22H23N3O3S
6-(2-Amino-2-oxoethyl)sulfanyl-5-cyano-N-(4-fluorophenyl)-4-(furan-2-yl)-2-methyl-1,4-dihydropyridine-3-carboxamide chemical structure, C20H17FN4O3S, CAS 663217-95-6
6-(2-Amino-2-oxoethyl)sulfanyl-5-cyano-N-(4-fluorophenyl)-4-(furan-2-yl)-2-methyl-1,4-dihydropyridine-3-carboxamide
CAS 663217-95-6C20H17FN4O3S
6-[2-(tert-Butylamino)-2-oxoethyl]sulfanyl-5-cyano-N-(2-fluorophenyl)-4-(furan-2-yl)-2-methyl-1,4-dihydropyridine-3-carboxamide chemical structure, C24H25FN4O3S, CAS 663218-02-8
6-[2-(tert-Butylamino)-2-oxoethyl]sulfanyl-5-cyano-N-(2-fluorophenyl)-4-(furan-2-yl)-2-methyl-1,4-dihydropyridine-3-carboxamide
CAS 663218-02-8C24H25FN4O3S
5-Cyano-6-(ethylsulfanyl)-N-(2-methoxyphenyl)-2-methyl-4-(5-methylfuran-2-yl)-1,4-dihydropyridine-3-carboxamide chemical structure, C22H23N3O3S, CAS 384858-44-0
5-Cyano-6-(ethylsulfanyl)-N-(2-methoxyphenyl)-2-methyl-4-(5-methylfuran-2-yl)-1,4-dihydropyridine-3-carboxamide
CAS 384858-44-0C22H23N3O3S
Ethyl 4-(6-((2-amino-2-oxoethyl)thio)-5-cyano-4-(furan-2-yl)-2-methyl-1,4-dihydropyridine-3-carboxamido)benzoate chemical structure, C23H22N4O5S, CAS 799801-27-7
Ethyl 4-(6-((2-amino-2-oxoethyl)thio)-5-cyano-4-(furan-2-yl)-2-methyl-1,4-dihydropyridine-3-carboxamido)benzoate
CAS 799801-27-7C23H22N4O5S
6-[(2-Amino-2-oxoethyl)sulfanyl]-5-cyano-N-(2,6-dimethylphenyl)-4-(furan-2-yl)-2-methyl-1,4-dihydropyridine-3-carboxamide chemical structure, C22H22N4O3S, CAS 897833-68-0
6-[(2-Amino-2-oxoethyl)sulfanyl]-5-cyano-N-(2,6-dimethylphenyl)-4-(furan-2-yl)-2-methyl-1,4-dihydropyridine-3-carboxamide
CAS 897833-68-0C22H22N4O3S