(4R)-4-(4-chlorophenyl)-3-ethanoyl-2-methyl-6-(2-oxidanylidenebutylsulfanyl)-3,4-dihydropyridine-5-carbonitrile

Systemtic Name: (4R)-4-(4-chlorophenyl)-3-ethanoyl-2-methyl-6-(2-oxidanylidenebutylsulfanyl)-3,4-dihydropyridine-5-carbonitrile Openeye Name: (4R)-3-acetyl-4-(4-chlorophenyl)-2-methyl-6-(2-oxobutylsulfanyl)-3,4-dihydropyridine-5-carbonitrile CAS Name: (4R)-3-acetyl-4-(4-chlorophenyl)-2-methyl-6-(2-oxobutylthio)-3,4-dihydropyridine-5-carbonitrile IUPAC Name: (4R)-3-acetyl-4-(4-chlorophenyl)-2-methyl-6-(2-oxobutylsulfanyl)-3,4-dihydropyridine-5-carbonitrile Traditional Name: (4R)-3-acetyl-4-(4-chlorophenyl)-6-(2-ketobutylthio)-2-methyl-3,4-dihydropyridine-5-carbonitrile Formula: C19H19ClN2O2S MolecularWeight: 374.88436

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)CSC1=C(C(C(C(=N1)C)C(=O)C)C2=CC=C(C=C2)Cl)C#N

Isomeric SMILES

CCC(=O)CSC1=C([C@H](C(C(=N1)C)C(=O)C)C2=CC=C(C=C2)Cl)C#N

InChI

InChI=1S/C19H19ClN2O2S/c1-4-15(24)10-25-19-16(9-21)18(13-5-7-14(20)8-6-13)17(12(3)23)11(2)22-19/h5-8,17-18H,4,10H2,1-3H3/t17?,18-/m1/s1