2-(cyanomethylsulfanyl)-N-(4-pentylphenyl)benzamide

Systemtic Name: 2-(cyanomethylsulfanyl)-N-(4-pentylphenyl)benzamide Openeye Name: 2-(cyanomethylsulfanyl)-N-(4-pentylphenyl)benzamide CAS Name: 2-(cyanomethylthio)-N-(4-pentylphenyl)benzamide IUPAC Name: 2-(cyanomethylsulfanyl)-N-(4-pentylphenyl)benzamide Traditional Name: N-(4-amylphenyl)-2-(cyanomethylthio)benzamide Formula: C20H22N2OS MolecularWeight: 338.46648

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2SCC#N

Isomeric SMILES

CCCCCC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2SCC#N

InChI

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