propan-2-yl 2-[[4-(4-chlorophenyl)-3-cyano-5-ethanoyl-6-methyl-1,4-dihydropyridin-2-yl]sulfanyl]ethanoate

Systemtic Name: propan-2-yl 2-[[4-(4-chlorophenyl)-3-cyano-5-ethanoyl-6-methyl-1,4-dihydropyridin-2-yl]sulfanyl]ethanoate Openeye Name: isopropyl 2-[[5-acetyl-4-(4-chlorophenyl)-3-cyano-6-methyl-1,4-dihydropyridin-2-yl]sulfanyl]acetate CAS Name: 2-[[5-acetyl-4-(4-chlorophenyl)-3-cyano-6-methyl-1,4-dihydropyridin-2-yl]thio]acetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[[5-acetyl-4-(4-chlorophenyl)-3-cyano-6-methyl-1,4-dihydropyridin-2-yl]sulfanyl]acetate Traditional Name: 2-[[5-acetyl-4-(4-chlorophenyl)-3-cyano-6-methyl-1,4-dihydropyridin-2-yl]thio]acetic acid isopropyl ester Formula: C20H21ClN2O3S MolecularWeight: 404.91034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)SCC(=O)OC(C)C)C#N)C2=CC=C(C=C2)Cl)C(=O)C

Isomeric SMILES

CC1=C(C(C(=C(N1)SCC(=O)OC(C)C)C#N)C2=CC=C(C=C2)Cl)C(=O)C

InChI

InChI=1S/C20H21ClN2O3S/c1-11(2)26-17(25)10-27-20-16(9-22)19(14-5-7-15(21)8-6-14)18(13(4)24)12(3)23-20/h5-8,11,19,23H,10H2,1-4H3