6-(3-phenylpiperazin-1-yl)-N-[phenyl(pyridin-2-yl)methyl]pyridine-3-carboxamide

Systemtic Name: 6-(3-phenylpiperazin-1-yl)-N-[phenyl(pyridin-2-yl)methyl]pyridine-3-carboxamide Openeye Name: 6-(3-phenylpiperazin-1-yl)-N-[phenyl(2-pyridyl)methyl]pyridine-3-carboxamide CAS Name: 6-(3-phenyl-1-piperazinyl)-N-[phenyl(2-pyridinyl)methyl]-3-pyridinecarboxamide IUPAC Name: 6-(3-phenylpiperazin-1-yl)-N-[phenyl(pyridin-2-yl)methyl]pyridine-3-carboxamide Traditional Name: 6-(3-phenylpiperazino)-N-[phenyl(2-pyridyl)methyl]nicotinamide Formula: C28H27N5O MolecularWeight: 449.54688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(N1)C2=CC=CC=C2)C3=NC=C(C=C3)C(=O)NC(C4=CC=CC=C4)C5=CC=CC=N5

Isomeric SMILES

C1CN(CC(N1)C2=CC=CC=C2)C3=NC=C(C=C3)C(=O)NC(C4=CC=CC=C4)C5=CC=CC=N5

InChI

InChI=1S/C28H27N5O/c34-28(32-27(22-11-5-2-6-12-22)24-13-7-8-16-29-24)23-14-15-26(31-19-23)33-18-17-30-25(20-33)21-9-3-1-4-10-21/h1-16,19,25,27,30H,17-18,20H2,(H,32,34)