methyl (6R)-4-methyl-6-phenyl-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: methyl (6R)-4-methyl-6-phenyl-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-1,6-dihydropyrimidine-5-carboxylate Openeye Name: methyl (6R)-4-methyl-6-phenyl-2-thioxo-3-[3-(trifluoromethyl)phenyl]-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6R)-4-methyl-6-phenyl-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-1,6-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl (6R)-4-methyl-6-phenyl-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6R)-4-methyl-6-phenyl-2-thioxo-3-[3-(trifluoromethyl)phenyl]-1,6-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C20H17F3N2O2S MolecularWeight: 406.42139

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1C2=CC=CC(=C2)C(F)(F)F)C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC1=C([C@H](NC(=S)N1C2=CC=CC(=C2)C(F)(F)F)C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C20H17F3N2O2S/c1-12-16(18(26)27-2)17(13-7-4-3-5-8-13)24-19(28)25(12)15-10-6-9-14(11-15)20(21,22)23/h3-11,17H,1-2H3,(H,24,28)/t17-/m1/s1