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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC(=O)C2=C(N=CC=C2)N3CCCC3C4=CN=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC(=O)C2=C(N=CC=C2)N3CCCC3C4=CN=CC=C4

InChI

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