2-(cyanomethylsulfanyl)-N-[4-(4-methylphenoxy)phenyl]benzamide

Systemtic Name: 2-(cyanomethylsulfanyl)-N-[4-(4-methylphenoxy)phenyl]benzamide Openeye Name: 2-(cyanomethylsulfanyl)-N-[4-(4-methylphenoxy)phenyl]benzamide CAS Name: 2-(cyanomethylthio)-N-[4-(4-methylphenoxy)phenyl]benzamide IUPAC Name: 2-(cyanomethylsulfanyl)-N-[4-(4-methylphenoxy)phenyl]benzamide Traditional Name: 2-(cyanomethylthio)-N-[4-(4-methylphenoxy)phenyl]benzamide Formula: C22H18N2O2S MolecularWeight: 374.45552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3SCC#N

Isomeric SMILES

CC1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3SCC#N

InChI

InChI=1S/C22H18N2O2S/c1-16-6-10-18(11-7-16)26-19-12-8-17(9-13-19)24-22(25)20-4-2-3-5-21(20)27-15-14-23/h2-13H,15H2,1H3,(H,24,25)