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

Systemtic Name: 4-(4-chlorophenyl)-6-hexylsulfanyl-2-oxidanylidene-3,4-dihydro-1H-pyridine-5-carbonitrile Openeye Name: 4-(4-chlorophenyl)-6-hexylsulfanyl-2-oxo-3,4-dihydro-1H-pyridine-5-carbonitrile CAS Name: 4-(4-chlorophenyl)-6-(hexylthio)-2-oxo-3,4-dihydro-1H-pyridine-5-carbonitrile IUPAC Name: 4-(4-chlorophenyl)-6-hexylsulfanyl-2-oxo-3,4-dihydro-1H-pyridine-5-carbonitrile Traditional Name: 4-(4-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=C(C=C2)Cl)C#N

Isomeric SMILES

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

InChI

InChI=1S/C18H21ClN2OS/c1-2-3-4-5-10-23-18-16(12-20)15(11-17(22)21-18)13-6-8-14(19)9-7-13/h6-9,15H,2-5,10-11H2,1H3,(H,21,22)