methyl (6S)-3-(3-fluoranyl-4-methyl-phenyl)-4-methyl-6-(2-methylphenyl)-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: methyl (6S)-3-(3-fluoranyl-4-methyl-phenyl)-4-methyl-6-(2-methylphenyl)-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: methyl (6S)-3-(3-fluoro-4-methyl-phenyl)-4-methyl-6-(o-tolyl)-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6S)-3-(3-fluoro-4-methylphenyl)-4-methyl-6-(2-methylphenyl)-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl (6S)-3-(3-fluoro-4-methylphenyl)-4-methyl-6-(2-methylphenyl)-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6S)-3-(3-fluoro-4-methyl-phenyl)-4-methyl-6-(o-tolyl)-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C21H21FN2O2S MolecularWeight: 384.467043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=C(C(NC2=S)C3=CC=CC=C3C)C(=O)OC)C)F

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=C([C@@H](NC2=S)C3=CC=CC=C3C)C(=O)OC)C)F

InChI

InChI=1S/C21H21FN2O2S/c1-12-7-5-6-8-16(12)19-18(20(25)26-4)14(3)24(21(27)23-19)15-10-9-13(2)17(22)11-15/h5-11,19H,1-4H3,(H,23,27)/t19-/m0/s1