ethyl (4R)-4-methyl-2-oxidanylidene-6-[[3-(trifluoromethyl)phenyl]sulfanylmethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl (4R)-4-methyl-2-oxidanylidene-6-[[3-(trifluoromethyl)phenyl]sulfanylmethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4R)-4-methyl-2-oxo-6-[[3-(trifluoromethyl)phenyl]sulfanylmethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4R)-4-methyl-2-oxo-6-[[[3-(trifluoromethyl)phenyl]thio]methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4R)-4-methyl-2-oxo-6-[[3-(trifluoromethyl)phenyl]sulfanylmethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4R)-2-keto-4-methyl-6-[[[3-(trifluoromethyl)phenyl]thio]methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C16H17F3N2O3S MolecularWeight: 374.37799

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C)CSC2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)N[C@@H]1C)CSC2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C16H17F3N2O3S/c1-3-24-14(22)13-9(2)20-15(23)21-12(13)8-25-11-6-4-5-10(7-11)16(17,18)19/h4-7,9H,3,8H2,1-2H3,(H2,20,21,23)/t9-/m1/s1