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

Systemtic Name: methyl (6R)-3-(3-fluoranyl-4-methyl-phenyl)-6-(2-fluorophenyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: methyl (6R)-3-(3-fluoro-4-methyl-phenyl)-6-(2-fluorophenyl)-4-methyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6R)-3-(3-fluoro-4-methylphenyl)-6-(2-fluorophenyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl (6R)-3-(3-fluoro-4-methylphenyl)-6-(2-fluorophenyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6R)-3-(3-fluoro-4-methyl-phenyl)-6-(2-fluorophenyl)-4-methyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C20H18F2N2O2S MolecularWeight: 388.430926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=C(C(NC2=S)C3=CC=CC=C3F)C(=O)OC)C)F

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=C([C@@H](NC2=S)C3=CC=CC=C3F)C(=O)OC)C)F

InChI

InChI=1S/C20H18F2N2O2S/c1-11-8-9-13(10-16(11)22)24-12(2)17(19(25)26-3)18(23-20(24)27)14-6-4-5-7-15(14)21/h4-10,18H,1-3H3,(H,23,27)/t18-/m0/s1