methyl (4S)-4-(2-chlorophenyl)-5-cyano-6-(2-methoxy-2-oxidanylidene-ethyl)sulfanyl-2-methyl-3,4-dihydropyridine-3-carboxylate

Systemtic Name: methyl (4S)-4-(2-chlorophenyl)-5-cyano-6-(2-methoxy-2-oxidanylidene-ethyl)sulfanyl-2-methyl-3,4-dihydropyridine-3-carboxylate Openeye Name: methyl (4S)-4-(2-chlorophenyl)-5-cyano-6-(2-methoxy-2-oxo-ethyl)sulfanyl-2-methyl-3,4-dihydropyridine-3-carboxylate CAS Name: (4S)-4-(2-chlorophenyl)-5-cyano-6-[(2-methoxy-2-oxoethyl)thio]-2-methyl-3,4-dihydropyridine-3-carboxylic acid methyl ester IUPAC Name: methyl (4S)-4-(2-chlorophenyl)-5-cyano-6-(2-methoxy-2-oxoethyl)sulfanyl-2-methyl-3,4-dihydropyridine-3-carboxylate Traditional Name: (4S)-4-(2-chlorophenyl)-5-cyano-6-[(2-keto-2-methoxy-ethyl)thio]-2-methyl-3,4-dihydropyridine-3-carboxylic acid methyl ester Formula: C18H17ClN2O4S MolecularWeight: 392.85658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(C1C(=O)OC)C2=CC=CC=C2Cl)C#N)SCC(=O)OC

Isomeric SMILES

CC1=NC(=C([C@H](C1C(=O)OC)C2=CC=CC=C2Cl)C#N)SCC(=O)OC

InChI

InChI=1S/C18H17ClN2O4S/c1-10-15(18(23)25-3)16(11-6-4-5-7-13(11)19)12(8-20)17(21-10)26-9-14(22)24-2/h4-7,15-16H,9H2,1-3H3/t15?,16-/m1/s1