N-(cyanomethyl)-4-methyl-2-[3-(2-piperazin-1-ylphenyl)phenyl]pentanamide

Systemtic Name: N-(cyanomethyl)-4-methyl-2-[3-(2-piperazin-1-ylphenyl)phenyl]pentanamide Openeye Name: N-(cyanomethyl)-4-methyl-2-[3-(2-piperazin-1-ylphenyl)phenyl]pentanamide CAS Name: N-(cyanomethyl)-4-methyl-2-[3-[2-(1-piperazinyl)phenyl]phenyl]pentanamide IUPAC Name: N-(cyanomethyl)-4-methyl-2-[3-(2-piperazin-1-ylphenyl)phenyl]pentanamide Traditional Name: N-(cyanomethyl)-4-methyl-2-[3-(2-piperazinophenyl)phenyl]valeramide Formula: C24H30N4O MolecularWeight: 390.5212

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC=CC(=C1)C2=CC=CC=C2N3CCNCC3)C(=O)NCC#N

Isomeric SMILES

CC(C)CC(C1=CC=CC(=C1)C2=CC=CC=C2N3CCNCC3)C(=O)NCC#N

InChI

InChI=1S/C24H30N4O/c1-18(2)16-22(24(29)27-11-10-25)20-7-5-6-19(17-20)21-8-3-4-9-23(21)28-14-12-26-13-15-28/h3-9,17-18,22,26H,11-16H2,1-2H3,(H,27,29)