N-(cyanomethyl)-4-methyl-2-[3-[3-(4-methylpiperazin-1-yl)carbonylphenyl]phenyl]pentanamide

Systemtic Name: N-(cyanomethyl)-4-methyl-2-[3-[3-(4-methylpiperazin-1-yl)carbonylphenyl]phenyl]pentanamide Openeye Name: N-(cyanomethyl)-4-methyl-2-[3-[3-(4-methylpiperazine-1-carbonyl)phenyl]phenyl]pentanamide CAS Name: N-(cyanomethyl)-4-methyl-2-[3-[3-[(4-methyl-1-piperazinyl)-oxomethyl]phenyl]phenyl]pentanamide IUPAC Name: N-(cyanomethyl)-4-methyl-2-[3-[3-(4-methylpiperazine-1-carbonyl)phenyl]phenyl]pentanamide Traditional Name: N-(cyanomethyl)-4-methyl-2-[3-[3-(4-methylpiperazine-1-carbonyl)phenyl]phenyl]valeramide Formula: C26H32N4O2 MolecularWeight: 432.55788

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC=CC(=C1)C2=CC(=CC=C2)C(=O)N3CCN(CC3)C)C(=O)NCC#N

Isomeric SMILES

CC(C)CC(C1=CC=CC(=C1)C2=CC(=CC=C2)C(=O)N3CCN(CC3)C)C(=O)NCC#N

InChI

InChI=1S/C26H32N4O2/c1-19(2)16-24(25(31)28-11-10-27)22-8-4-6-20(17-22)21-7-5-9-23(18-21)26(32)30-14-12-29(3)13-15-30/h4-9,17-19,24H,11-16H2,1-3H3,(H,28,31)