(4S)-4-(2-chlorophenyl)-6-hexylsulfanyl-2-oxidanylidene-3,4-dihydro-1H-pyridine-5-carbonitrile

Systemtic Name: (4S)-4-(2-chlorophenyl)-6-hexylsulfanyl-2-oxidanylidene-3,4-dihydro-1H-pyridine-5-carbonitrile Openeye Name: (4S)-4-(2-chlorophenyl)-6-hexylsulfanyl-2-oxo-3,4-dihydro-1H-pyridine-5-carbonitrile CAS Name: (4S)-4-(2-chlorophenyl)-6-(hexylthio)-2-oxo-3,4-dihydro-1H-pyridine-5-carbonitrile IUPAC Name: (4S)-4-(2-chlorophenyl)-6-hexylsulfanyl-2-oxo-3,4-dihydro-1H-pyridine-5-carbonitrile Traditional Name: (4S)-4-(2-chlorophenyl)-6-(hexylthio)-2-keto-3,4-dihydro-1H-pyridine-5-carbonitrile Formula: C18H21ClN2OS MolecularWeight: 348.89014

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC1=C(C(CC(=O)N1)C2=CC=CC=C2Cl)C#N

Isomeric SMILES

CCCCCCSC1=C([C@H](CC(=O)N1)C2=CC=CC=C2Cl)C#N

InChI

InChI=1S/C18H21ClN2OS/c1-2-3-4-7-10-23-18-15(12-20)14(11-17(22)21-18)13-8-5-6-9-16(13)19/h5-6,8-9,14H,2-4,7,10-11H2,1H3,(H,21,22)/t14-/m1/s1