N-(cyanomethyl)-N-phenyl-2-(2,3,5,6-tetramethylphenyl)sulfanyl-ethanamide

Systemtic Name: N-(cyanomethyl)-N-phenyl-2-(2,3,5,6-tetramethylphenyl)sulfanyl-ethanamide Openeye Name: N-(cyanomethyl)-N-phenyl-2-(2,3,5,6-tetramethylphenyl)sulfanyl-acetamide CAS Name: N-(cyanomethyl)-N-phenyl-2-[(2,3,5,6-tetramethylphenyl)thio]acetamide IUPAC Name: N-(cyanomethyl)-N-phenyl-2-(2,3,5,6-tetramethylphenyl)sulfanylacetamide Traditional Name: N-(cyanomethyl)-N-phenyl-2-[(2,3,5,6-tetramethylphenyl)thio]acetamide Formula: C20H22N2OS MolecularWeight: 338.46648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)SCC(=O)N(CC#N)C2=CC=CC=C2)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)SCC(=O)N(CC#N)C2=CC=CC=C2)C)C

InChI

InChI=1S/C20H22N2OS/c1-14-12-15(2)17(4)20(16(14)3)24-13-19(23)22(11-10-21)18-8-6-5-7-9-18/h5-9,12H,11,13H2,1-4H3