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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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