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

Systemtic Name: 6-hexylsulfanyl-4-(3-methylthiophen-2-yl)-2-oxidanylidene-3,4-dihydro-1H-pyridine-5-carbonitrile Openeye Name: 6-hexylsulfanyl-4-(3-methyl-2-thienyl)-2-oxo-3,4-dihydro-1H-pyridine-5-carbonitrile CAS Name: 6-(hexylthio)-4-(3-methyl-2-thiophenyl)-2-oxo-3,4-dihydro-1H-pyridine-5-carbonitrile IUPAC Name: 6-hexylsulfanyl-4-(3-methylthiophen-2-yl)-2-oxo-3,4-dihydro-1H-pyridine-5-carbonitrile Traditional Name: 6-(hexylthio)-2-keto-4-(3-methyl-2-thienyl)-3,4-dihydro-1H-pyridine-5-carbonitrile Formula: C17H22N2OS2 MolecularWeight: 334.49938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC1=C(C(CC(=O)N1)C2=C(C=CS2)C)C#N

Isomeric SMILES

CCCCCCSC1=C(C(CC(=O)N1)C2=C(C=CS2)C)C#N

InChI

InChI=1S/C17H22N2OS2/c1-3-4-5-6-8-22-17-14(11-18)13(10-15(20)19-17)16-12(2)7-9-21-16/h7,9,13H,3-6,8,10H2,1-2H3,(H,19,20)