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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H30N4O/c1-3-5-23(24(29)26-13-12-25)21-7-4-6-20(18-21)19-8-10-22(11-9-19)28-16-14-27(2)15-17-28/h4,6-11,18,23H,3,5,13-17H2,1-2H3,(H,26,29)