methyl (6R)-3-(2,5-dimethylphenyl)-6-(4-imidazol-1-ylphenyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: methyl (6R)-3-(2,5-dimethylphenyl)-6-(4-imidazol-1-ylphenyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: methyl (6R)-3-(2,5-dimethylphenyl)-6-(4-imidazol-1-ylphenyl)-4-methyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6R)-3-(2,5-dimethylphenyl)-6-[4-(1-imidazolyl)phenyl]-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl (6R)-3-(2,5-dimethylphenyl)-6-(4-imidazol-1-ylphenyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6R)-3-(2,5-dimethylphenyl)-6-(4-imidazol-1-ylphenyl)-4-methyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C24H24N4O2S MolecularWeight: 432.53796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C(=C(C(NC2=S)C3=CC=C(C=C3)N4C=CN=C4)C(=O)OC)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C(=C([C@H](NC2=S)C3=CC=C(C=C3)N4C=CN=C4)C(=O)OC)C

InChI

InChI=1S/C24H24N4O2S/c1-15-5-6-16(2)20(13-15)28-17(3)21(23(29)30-4)22(26-24(28)31)18-7-9-19(10-8-18)27-12-11-25-14-27/h5-14,22H,1-4H3,(H,26,31)/t22-/m1/s1