(4S,5R)-4-(2-chlorophenyl)-5-ethanoyl-2-(2-ethoxyethylsulfanyl)-6-methylidene-4,5-dihydro-3H-pyridine-3-carbonitrile

Systemtic Name: (4S,5R)-4-(2-chlorophenyl)-5-ethanoyl-2-(2-ethoxyethylsulfanyl)-6-methylidene-4,5-dihydro-3H-pyridine-3-carbonitrile Openeye Name: (4S,5R)-5-acetyl-4-(2-chlorophenyl)-2-(2-ethoxyethylsulfanyl)-6-methylene-4,5-dihydro-3H-pyridine-3-carbonitrile CAS Name: (4S,5R)-5-acetyl-4-(2-chlorophenyl)-2-(2-ethoxyethylthio)-6-methylene-4,5-dihydro-3H-pyridine-3-carbonitrile IUPAC Name: (4S,5R)-5-acetyl-4-(2-chlorophenyl)-2-(2-ethoxyethylsulfanyl)-6-methylidene-4,5-dihydro-3H-pyridine-3-carbonitrile Traditional Name: (4S,5R)-5-acetyl-4-(2-chlorophenyl)-2-(2-ethoxyethylthio)-6-methylene-4,5-dihydro-3H-pyridine-3-carbonitrile Formula: C19H21ClN2O2S MolecularWeight: 376.90024

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCSC1=NC(=C)C(C(C1C#N)C2=CC=CC=C2Cl)C(=O)C

Isomeric SMILES

CCOCCSC1=NC(=C)[C@@H]([C@@H](C1C#N)C2=CC=CC=C2Cl)C(=O)C

InChI

InChI=1S/C19H21ClN2O2S/c1-4-24-9-10-25-19-15(11-21)18(14-7-5-6-8-16(14)20)17(13(3)23)12(2)22-19/h5-8,15,17-18H,2,4,9-10H2,1,3H3/t15?,17-,18-/m1/s1