methyl 2-[[(4S)-4-(4-chlorophenyl)-5-cyano-3-ethanoyl-2-methyl-3,4-dihydropyridin-6-yl]sulfanyl]ethanoate

Systemtic Name: methyl 2-[[(4S)-4-(4-chlorophenyl)-5-cyano-3-ethanoyl-2-methyl-3,4-dihydropyridin-6-yl]sulfanyl]ethanoate Openeye Name: methyl 2-[[(4S)-3-acetyl-4-(4-chlorophenyl)-5-cyano-2-methyl-3,4-dihydropyridin-6-yl]sulfanyl]acetate CAS Name: 2-[[(4S)-3-acetyl-4-(4-chlorophenyl)-5-cyano-2-methyl-3,4-dihydropyridin-6-yl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[[(4S)-3-acetyl-4-(4-chlorophenyl)-5-cyano-2-methyl-3,4-dihydropyridin-6-yl]sulfanyl]acetate Traditional Name: 2-[[(4S)-3-acetyl-4-(4-chlorophenyl)-5-cyano-2-methyl-3,4-dihydropyridin-6-yl]thio]acetic acid methyl ester Formula: C18H17ClN2O3S MolecularWeight: 376.85718

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17ClN2O3S/c1-10-16(11(2)22)17(12-4-6-13(19)7-5-12)14(8-20)18(21-10)25-9-15(23)24-3/h4-7,16-17H,9H2,1-3H3/t16?,17-/m0/s1