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

Systemtic Name: N-(cyanomethyl)-4-methyl-2-[[2-(4-piperazin-1-ylphenyl)phenyl]methoxy]pentanamide Openeye Name: N-(cyanomethyl)-4-methyl-2-[[2-(4-piperazin-1-ylphenyl)phenyl]methoxy]pentanamide CAS Name: N-(cyanomethyl)-4-methyl-2-[[2-[4-(1-piperazinyl)phenyl]phenyl]methoxy]pentanamide IUPAC Name: N-(cyanomethyl)-4-methyl-2-[[2-(4-piperazin-1-ylphenyl)phenyl]methoxy]pentanamide Traditional Name: N-(cyanomethyl)-4-methyl-2-[2-(4-piperazinophenyl)benzyl]oxy-valeramide Formula: C25H32N4O2 MolecularWeight: 420.54718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NCC#N)OCC1=CC=CC=C1C2=CC=C(C=C2)N3CCNCC3

Isomeric SMILES

CC(C)CC(C(=O)NCC#N)OCC1=CC=CC=C1C2=CC=C(C=C2)N3CCNCC3

InChI

InChI=1S/C25H32N4O2/c1-19(2)17-24(25(30)28-12-11-26)31-18-21-5-3-4-6-23(21)20-7-9-22(10-8-20)29-15-13-27-14-16-29/h3-10,19,24,27H,12-18H2,1-2H3,(H,28,30)