N-(4-butylphenyl)-6-(2-pyridin-2-ylpyrrolidin-1-yl)pyridine-3-carboxamide

Systemtic Name: N-(4-butylphenyl)-6-(2-pyridin-2-ylpyrrolidin-1-yl)pyridine-3-carboxamide Openeye Name: N-(4-butylphenyl)-6-[2-(2-pyridyl)pyrrolidin-1-yl]pyridine-3-carboxamide CAS Name: N-(4-butylphenyl)-6-[2-(2-pyridinyl)-1-pyrrolidinyl]-3-pyridinecarboxamide IUPAC Name: N-(4-butylphenyl)-6-(2-pyridin-2-ylpyrrolidin-1-yl)pyridine-3-carboxamide Traditional Name: N-(4-butylphenyl)-6-[2-(2-pyridyl)pyrrolidino]nicotinamide Formula: C25H28N4O MolecularWeight: 400.51602

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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