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

Systemtic Name: N-(cyanomethyl)-4-methyl-2-[1-[4-(4-piperazin-1-ylphenyl)phenyl]ethoxy]pentanamide Openeye Name: N-(cyanomethyl)-4-methyl-2-[1-[4-(4-piperazin-1-ylphenyl)phenyl]ethoxy]pentanamide CAS Name: N-(cyanomethyl)-4-methyl-2-[1-[4-[4-(1-piperazinyl)phenyl]phenyl]ethoxy]pentanamide IUPAC Name: N-(cyanomethyl)-4-methyl-2-[1-[4-(4-piperazin-1-ylphenyl)phenyl]ethoxy]pentanamide Traditional Name: N-(cyanomethyl)-4-methyl-2-[1-[4-(4-piperazinophenyl)phenyl]ethoxy]valeramide Formula: C26H34N4O2 MolecularWeight: 434.57376

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H34N4O2/c1-19(2)18-25(26(31)29-13-12-27)32-20(3)21-4-6-22(7-5-21)23-8-10-24(11-9-23)30-16-14-28-15-17-30/h4-11,19-20,25,28H,13-18H2,1-3H3,(H,29,31)