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

Systemtic Name: N-(pyridin-3-ylmethyl)-2-(2-pyridin-4-ylpyrrolidin-1-yl)pyridine-3-carboxamide Openeye Name: N-(3-pyridylmethyl)-2-[2-(4-pyridyl)pyrrolidin-1-yl]pyridine-3-carboxamide CAS Name: N-(3-pyridinylmethyl)-2-(2-pyridin-4-yl-1-pyrrolidinyl)-3-pyridinecarboxamide IUPAC Name: N-(pyridin-3-ylmethyl)-2-(2-pyridin-4-ylpyrrolidin-1-yl)pyridine-3-carboxamide Traditional Name: N-(3-pyridylmethyl)-2-[2-(4-pyridyl)pyrrolidino]nicotinamide Formula: C21H21N5O MolecularWeight: 359.42434

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C2=C(C=CC=N2)C(=O)NCC3=CN=CC=C3)C4=CC=NC=C4

Isomeric SMILES

C1CC(N(C1)C2=C(C=CC=N2)C(=O)NCC3=CN=CC=C3)C4=CC=NC=C4

InChI

InChI=1S/C21H21N5O/c27-21(25-15-16-4-1-9-23-14-16)18-5-2-10-24-20(18)26-13-3-6-19(26)17-7-11-22-12-8-17/h1-2,4-5,7-12,14,19H,3,6,13,15H2,(H,25,27)