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

Systemtic Name: N-(cyanomethyl)-4-methyl-2-[3-[4-(4-methylpiperazin-1-yl)phenyl]phenyl]hexanamide Openeye Name: N-(cyanomethyl)-4-methyl-2-[3-[4-(4-methylpiperazin-1-yl)phenyl]phenyl]hexanamide CAS Name: N-(cyanomethyl)-4-methyl-2-[3-[4-(4-methyl-1-piperazinyl)phenyl]phenyl]hexanamide IUPAC Name: N-(cyanomethyl)-4-methyl-2-[3-[4-(4-methylpiperazin-1-yl)phenyl]phenyl]hexanamide Traditional Name: N-(cyanomethyl)-4-methyl-2-[3-[4-(4-methylpiperazino)phenyl]phenyl]hexanamide Formula: C26H34N4O MolecularWeight: 418.57436

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H34N4O/c1-4-20(2)18-25(26(31)28-13-12-27)23-7-5-6-22(19-23)21-8-10-24(11-9-21)30-16-14-29(3)15-17-30/h5-11,19-20,25H,4,13-18H2,1-3H3,(H,28,31)