N-(4-phenylbutan-2-yl)-1-(3-pyrrol-1-ylpyridin-2-yl)piperidine-4-carboxamide

Systemtic Name: N-(4-phenylbutan-2-yl)-1-(3-pyrrol-1-ylpyridin-2-yl)piperidine-4-carboxamide Openeye Name: N-(1-methyl-3-phenyl-propyl)-1-(3-pyrrol-1-yl-2-pyridyl)piperidine-4-carboxamide CAS Name: N-(4-phenylbutan-2-yl)-1-[3-(1-pyrrolyl)-2-pyridinyl]-4-piperidinecarboxamide IUPAC Name: N-(4-phenylbutan-2-yl)-1-(3-pyrrol-1-ylpyridin-2-yl)piperidine-4-carboxamide Traditional Name: N-(1-methyl-3-phenyl-propyl)-1-(3-pyrrol-1-yl-2-pyridyl)isonipecotamide Formula: C25H30N4O MolecularWeight: 402.5319

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NC(=O)C2CCN(CC2)C3=C(C=CC=N3)N4C=CC=C4

Isomeric SMILES

CC(CCC1=CC=CC=C1)NC(=O)C2CCN(CC2)C3=C(C=CC=N3)N4C=CC=C4

InChI

InChI=1S/C25H30N4O/c1-20(11-12-21-8-3-2-4-9-21)27-25(30)22-13-18-29(19-14-22)24-23(10-7-15-26-24)28-16-5-6-17-28/h2-10,15-17,20,22H,11-14,18-19H2,1H3,(H,27,30)