N-(1-cyanocycloheptyl)-2-(3,4-dimethylphenyl)sulfanyl-ethanamide

Systemtic Name: N-(1-cyanocycloheptyl)-2-(3,4-dimethylphenyl)sulfanyl-ethanamide Openeye Name: N-(1-cyanocycloheptyl)-2-(3,4-dimethylphenyl)sulfanyl-acetamide CAS Name: N-(1-cyanocycloheptyl)-2-[(3,4-dimethylphenyl)thio]acetamide IUPAC Name: N-(1-cyanocycloheptyl)-2-(3,4-dimethylphenyl)sulfanylacetamide Traditional Name: N-(1-cyanocycloheptyl)-2-[(3,4-dimethylphenyl)thio]acetamide Formula: C18H24N2OS MolecularWeight: 316.46096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SCC(=O)NC2(CCCCCC2)C#N)C

Isomeric SMILES

CC1=C(C=C(C=C1)SCC(=O)NC2(CCCCCC2)C#N)C

InChI

InChI=1S/C18H24N2OS/c1-14-7-8-16(11-15(14)2)22-12-17(21)20-18(13-19)9-5-3-4-6-10-18/h7-8,11H,3-6,9-10,12H2,1-2H3,(H,20,21)