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

Systemtic Name: 4-(4-ethylphenyl)-6-hexylsulfanyl-2-oxidanylidene-3,4-dihydro-1H-pyridine-5-carbonitrile Openeye Name: 4-(4-ethylphenyl)-6-hexylsulfanyl-2-oxo-3,4-dihydro-1H-pyridine-5-carbonitrile CAS Name: 4-(4-ethylphenyl)-6-(hexylthio)-2-oxo-3,4-dihydro-1H-pyridine-5-carbonitrile IUPAC Name: 4-(4-ethylphenyl)-6-hexylsulfanyl-2-oxo-3,4-dihydro-1H-pyridine-5-carbonitrile Traditional Name: 4-(4-ethylphenyl)-6-(hexylthio)-2-keto-3,4-dihydro-1H-pyridine-5-carbonitrile Formula: C20H26N2OS MolecularWeight: 342.49824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26N2OS/c1-3-5-6-7-12-24-20-18(14-21)17(13-19(23)22-20)16-10-8-15(4-2)9-11-16/h8-11,17H,3-7,12-13H2,1-2H3,(H,22,23)