6-ethoxy-N-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]pyridine-3-carboxamide

Systemtic Name: 6-ethoxy-N-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]pyridine-3-carboxamide Openeye Name: N-[4-(4-benzylpiperazin-1-yl)phenyl]-6-ethoxy-pyridine-3-carboxamide CAS Name: 6-ethoxy-N-[4-[4-(phenylmethyl)-1-piperazinyl]phenyl]-3-pyridinecarboxamide IUPAC Name: N-[4-(4-benzylpiperazin-1-yl)phenyl]-6-ethoxypyridine-3-carboxamide Traditional Name: N-[4-(4-benzylpiperazino)phenyl]-6-ethoxy-nicotinamide Formula: C25H28N4O2 MolecularWeight: 416.51542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CCOC1=NC=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C25H28N4O2/c1-2-31-24-13-8-21(18-26-24)25(30)27-22-9-11-23(12-10-22)29-16-14-28(15-17-29)19-20-6-4-3-5-7-20/h3-13,18H,2,14-17,19H2,1H3,(H,27,30)