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

Systemtic Name: N-(cyanomethyl)-4-methyl-2-[[4-(4-piperazin-1-ylphenyl)phenyl]amino]pentanamide Openeye Name: N-(cyanomethyl)-4-methyl-2-[4-(4-piperazin-1-ylphenyl)anilino]pentanamide CAS Name: N-(cyanomethyl)-4-methyl-2-[4-[4-(1-piperazinyl)phenyl]anilino]pentanamide IUPAC Name: N-(cyanomethyl)-4-methyl-2-[4-(4-piperazin-1-ylphenyl)anilino]pentanamide Traditional Name: N-(cyanomethyl)-4-methyl-2-[4-(4-piperazinophenyl)anilino]valeramide Formula: C24H31N5O MolecularWeight: 405.53584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NCC#N)NC1=CC=C(C=C1)C2=CC=C(C=C2)N3CCNCC3

Isomeric SMILES

CC(C)CC(C(=O)NCC#N)NC1=CC=C(C=C1)C2=CC=C(C=C2)N3CCNCC3

InChI

InChI=1S/C24H31N5O/c1-18(2)17-23(24(30)27-12-11-25)28-21-7-3-19(4-8-21)20-5-9-22(10-6-20)29-15-13-26-14-16-29/h3-10,18,23,26,28H,12-17H2,1-2H3,(H,27,30)