2-(2-methylphenyl)-3-oxidanylidene-6-thiophen-2-yl-hexanenitrile

Systemtic Name: 2-(2-methylphenyl)-3-oxidanylidene-6-thiophen-2-yl-hexanenitrile Openeye Name: 2-(o-tolyl)-3-oxo-6-(2-thienyl)hexanenitrile CAS Name: 2-(2-methylphenyl)-3-oxo-6-thiophen-2-ylhexanenitrile IUPAC Name: 2-(2-methylphenyl)-3-oxo-6-thiophen-2-ylhexanenitrile Traditional Name: 3-keto-2-(o-tolyl)-6-(2-thienyl)hexanenitrile Formula: C17H17NOS MolecularWeight: 283.38798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C#N)C(=O)CCCC2=CC=CS2

Isomeric SMILES

CC1=CC=CC=C1C(C#N)C(=O)CCCC2=CC=CS2

InChI

InChI=1S/C17H17NOS/c1-13-6-2-3-9-15(13)16(12-18)17(19)10-4-7-14-8-5-11-20-14/h2-3,5-6,8-9,11,16H,4,7,10H2,1H3