N-[4-(cyanomethylsulfanyl)phenyl]pentanamide

Systemtic Name: N-[4-(cyanomethylsulfanyl)phenyl]pentanamide Openeye Name: N-[4-(cyanomethylsulfanyl)phenyl]pentanamide CAS Name: N-[4-(cyanomethylthio)phenyl]pentanamide IUPAC Name: N-[4-(cyanomethylsulfanyl)phenyl]pentanamide Traditional Name: N-[4-(cyanomethylthio)phenyl]valeramide Formula: C13H16N2OS MolecularWeight: 248.34394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=CC=C(C=C1)SCC#N

Isomeric SMILES

CCCCC(=O)NC1=CC=C(C=C1)SCC#N

InChI

InChI=1S/C13H16N2OS/c1-2-3-4-13(16)15-11-5-7-12(8-6-11)17-10-9-14/h5-8H,2-4,10H2,1H3,(H,15,16)