N-[5-chloranyl-2-(4-methylpiperazin-1-yl)phenyl]-1-(5-cyanopyridin-2-yl)piperidine-4-carboxamide

Systemtic Name: N-[5-chloranyl-2-(4-methylpiperazin-1-yl)phenyl]-1-(5-cyanopyridin-2-yl)piperidine-4-carboxamide Openeye Name: N-[5-chloro-2-(4-methylpiperazin-1-yl)phenyl]-1-(5-cyano-2-pyridyl)piperidine-4-carboxamide CAS Name: N-[5-chloro-2-(4-methyl-1-piperazinyl)phenyl]-1-(5-cyano-2-pyridinyl)-4-piperidinecarboxamide IUPAC Name: N-[5-chloro-2-(4-methylpiperazin-1-yl)phenyl]-1-(5-cyanopyridin-2-yl)piperidine-4-carboxamide Traditional Name: N-[5-chloro-2-(4-methylpiperazino)phenyl]-1-(5-cyano-2-pyridyl)isonipecotamide Formula: C23H27ClN6O MolecularWeight: 438.95308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)C3CCN(CC3)C4=NC=C(C=C4)C#N

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)C3CCN(CC3)C4=NC=C(C=C4)C#N

InChI

InChI=1S/C23H27ClN6O/c1-28-10-12-29(13-11-28)21-4-3-19(24)14-20(21)27-23(31)18-6-8-30(9-7-18)22-5-2-17(15-25)16-26-22/h2-5,14,16,18H,6-13H2,1H3,(H,27,31)