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Murcko scaffold

Ring system with 2 rings and 13 atoms

230 chemicals on CompoundList share this ring system.

Rings
2
Scaffold atoms
13
Chemicals
230
With full pages
38
Scaffold SMILES

S=C1NC=CC(c2ccccc2)N1

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 S=C1NC=CC(c2ccccc2)N1

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 193 to 230 of 230 chemicals

Methyl 4-(3-bromo-4-fluorophenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate chemical structure, C13H12BrFN2O2S, CAS 385400-53-3
Methyl 4-(3-bromo-4-fluorophenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
CAS 385400-53-3C13H12BrFN2O2S
Ethyl 4-(2,4-dichlorophenyl)-1,6-dimethyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate chemical structure, C15H16Cl2N2O2S, CAS 367907-53-7
Ethyl 4-(2,4-dichlorophenyl)-1,6-dimethyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
CAS 367907-53-7C15H16Cl2N2O2S
Isobutyl 4-(4-fluorophenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate chemical structure, C16H19FN2O2S, CAS 608495-09-6
Isobutyl 4-(4-fluorophenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
CAS 608495-09-6C16H19FN2O2S
Methyl 4-(4-hydroxy-3-iodo-5-methoxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate chemical structure, C14H15IN2O4S, CAS 354775-86-3
Methyl 4-(4-hydroxy-3-iodo-5-methoxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
CAS 354775-86-3C14H15IN2O4S
Methyl 4-[4-[bis(2-chloroethyl)amino]-2-chlorophenyl]-1,2,3,4-tetrahydro-6-methyl-2-thioxo-5-pyrimidinecarboxylate chemical structure, C17H20Cl3N3O2S, CAS 906730-66-3
Methyl 4-[4-[bis(2-chloroethyl)amino]-2-chlorophenyl]-1,2,3,4-tetrahydro-6-methyl-2-thioxo-5-pyrimidinecarboxylate
CAS 906730-66-3C17H20Cl3N3O2S
Ethyl 4-(3,4-dimethoxyphenyl)-1,6-dimethyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate chemical structure, C17H22N2O4S, CAS 144460-03-7
Ethyl 4-(3,4-dimethoxyphenyl)-1,6-dimethyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
CAS 144460-03-7C17H22N2O4S
Ethyl 4-(3-bromo-4-fluorophenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate chemical structure, C14H14BrFN2O2S, CAS 394226-74-5
Ethyl 4-(3-bromo-4-fluorophenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
CAS 394226-74-5C14H14BrFN2O2S
Methyl 6-(2,5-dimethoxyphenyl)-3,4-dimethyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate chemical structure, C16H20N2O4S, CAS 367907-58-2
Methyl 6-(2,5-dimethoxyphenyl)-3,4-dimethyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate
CAS 367907-58-2C16H20N2O4S
Ethyl 6-(nonafluorobutyl)-4-phenyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate chemical structure, C17H13F9N2O2S, CAS 281189-83-1
Ethyl 6-(nonafluorobutyl)-4-phenyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
CAS 281189-83-1C17H13F9N2O2S
4-(2,3-Dichlorophenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxamide chemical structure, C12H11Cl2N3OS, CAS 392740-15-7
4-(2,3-Dichlorophenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxamide
CAS 392740-15-7C12H11Cl2N3OS
{2-Bromo-6-ethoxy-4-[5-(ethoxycarbonyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidin-4-yl]phenoxy}acetic acid chemical structure, C18H21BrN2O6S, CAS 444934-93-4
{2-Bromo-6-ethoxy-4-[5-(ethoxycarbonyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidin-4-yl]phenoxy}acetic acid
CAS 444934-93-4C18H21BrN2O6S
Allyl 4-(4-chlorophenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate chemical structure, C15H15ClN2O2S, CAS 683794-18-5
Allyl 4-(4-chlorophenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
CAS 683794-18-5C15H15ClN2O2S
Ethyl 4-(2-hydroxy-5-nitrophenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate chemical structure, C14H15N3O5S, CAS 5236-71-5
Ethyl 4-(2-hydroxy-5-nitrophenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate
CAS 5236-71-5C14H15N3O5S
1-[4-(5-Bromo-2-methoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]ethanone chemical structure, C14H15BrN2O2S, CAS 444935-67-5
1-[4-(5-Bromo-2-methoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]ethanone
CAS 444935-67-5C14H15BrN2O2S
Isobutyl 4-(2-bromophenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate chemical structure, C16H19BrN2O2S, CAS 616212-45-4
Isobutyl 4-(2-bromophenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
CAS 616212-45-4C16H19BrN2O2S
Methyl 3-acetyl-4-(3,4-dimethoxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate chemical structure, C17H20N2O5S, CAS 330567-79-8
Methyl 3-acetyl-4-(3,4-dimethoxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
CAS 330567-79-8C17H20N2O5S
2-Methoxyethyl 4-(4-bromophenyl)-1-ethyl-1,2,3,4-tetrahydro-6-methyl-2-thioxo-5-pyrimidinecarboxylate chemical structure, C17H21BrN2O3S, CAS 726153-56-6
2-Methoxyethyl 4-(4-bromophenyl)-1-ethyl-1,2,3,4-tetrahydro-6-methyl-2-thioxo-5-pyrimidinecarboxylate
CAS 726153-56-6C17H21BrN2O3S
Methyl 4-[3-(3,3-dimethylbutanamido)phenyl]-1,6-dimethyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate chemical structure, C20H27N3O3S, CAS 5993-70-4
Methyl 4-[3-(3,3-dimethylbutanamido)phenyl]-1,6-dimethyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
CAS 5993-70-4C20H27N3O3S
Ethyl 4-{3-[(dimethylcarbamoyl)amino]phenyl}-1,6-dimethyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate chemical structure, C18H24N4O3S, CAS 5993-54-4
Ethyl 4-{3-[(dimethylcarbamoyl)amino]phenyl}-1,6-dimethyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
CAS 5993-54-4C18H24N4O3S
Propan-2-yl 3,4-dimethyl-6-(3-nitrophenyl)-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate chemical structure, C16H19N3O4S, CAS 6998-34-1
Propan-2-yl 3,4-dimethyl-6-(3-nitrophenyl)-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate
CAS 6998-34-1C16H19N3O4S
Ethyl (4S)-3-formyl-1,6-dimethyl-4-phenyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate chemical structure, C16H18N2O3S
Ethyl (4S)-3-formyl-1,6-dimethyl-4-phenyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
C16H18N2O3S
6-Amino-1,2,3,4-tetrahydro-4-(4-methylphenyl)-2-thioxo-5-pyrimidinecarboxamide chemical structure, C12H14N4OS, CAS 98011-29-1
6-Amino-1,2,3,4-tetrahydro-4-(4-methylphenyl)-2-thioxo-5-pyrimidinecarboxamide
CAS 98011-29-1C12H14N4OS
Methyl 1,2,3,4-tetrahydro-6-methyl-4-(2-methylphenyl)-2-thioxo-5-pyrimidinecarboxylate chemical structure, C14H16N2O2S, CAS 211929-95-2
Methyl 1,2,3,4-tetrahydro-6-methyl-4-(2-methylphenyl)-2-thioxo-5-pyrimidinecarboxylate
CAS 211929-95-2C14H16N2O2S
6-Methyl-4-(3-nitrophenyl)-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxamide chemical structure, C12H12N4O3S, CAS 725216-96-6
6-Methyl-4-(3-nitrophenyl)-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxamide
CAS 725216-96-6C12H12N4O3S