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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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