N-(cyanomethyl)-4-methyl-2-(2-phenylphenyl)sulfanyl-pentanamide

Systemtic Name: N-(cyanomethyl)-4-methyl-2-(2-phenylphenyl)sulfanyl-pentanamide Openeye Name: N-(cyanomethyl)-4-methyl-2-(2-phenylphenyl)sulfanyl-pentanamide CAS Name: N-(cyanomethyl)-4-methyl-2-[(2-phenylphenyl)thio]pentanamide IUPAC Name: N-(cyanomethyl)-4-methyl-2-(2-phenylphenyl)sulfanylpentanamide Traditional Name: N-(cyanomethyl)-4-methyl-2-[(2-phenylphenyl)thio]valeramide Formula: C20H22N2OS MolecularWeight: 338.46648

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NCC#N)SC1=CC=CC=C1C2=CC=CC=C2

Isomeric SMILES

CC(C)CC(C(=O)NCC#N)SC1=CC=CC=C1C2=CC=CC=C2

InChI

InChI=1S/C20H22N2OS/c1-15(2)14-19(20(23)22-13-12-21)24-18-11-7-6-10-17(18)16-8-4-3-5-9-16/h3-11,15,19H,13-14H2,1-2H3,(H,22,23)