N-(4-butylphenyl)-2-(2-pyridin-2-ylpyrrolidin-1-yl)pyridine-3-carboxamide

Systemtic Name: N-(4-butylphenyl)-2-(2-pyridin-2-ylpyrrolidin-1-yl)pyridine-3-carboxamide Openeye Name: N-(4-butylphenyl)-2-[2-(2-pyridyl)pyrrolidin-1-yl]pyridine-3-carboxamide CAS Name: N-(4-butylphenyl)-2-[2-(2-pyridinyl)-1-pyrrolidinyl]-3-pyridinecarboxamide IUPAC Name: N-(4-butylphenyl)-2-(2-pyridin-2-ylpyrrolidin-1-yl)pyridine-3-carboxamide Traditional Name: N-(4-butylphenyl)-2-[2-(2-pyridyl)pyrrolidino]nicotinamide Formula: C25H28N4O MolecularWeight: 400.51602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C2=C(N=CC=C2)N3CCCC3C4=CC=CC=N4

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)C2=C(N=CC=C2)N3CCCC3C4=CC=CC=N4

InChI

InChI=1S/C25H28N4O/c1-2-3-8-19-12-14-20(15-13-19)28-25(30)21-9-6-17-27-24(21)29-18-7-11-23(29)22-10-4-5-16-26-22/h4-6,9-10,12-17,23H,2-3,7-8,11,18H2,1H3,(H,28,30)