2-pyrrolidin-1-yl-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]pyridine-3-carboxamide

Systemtic Name: 2-pyrrolidin-1-yl-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]pyridine-3-carboxamide Openeye Name: 2-pyrrolidin-1-yl-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]pyridine-3-carboxamide CAS Name: 2-(1-pyrrolidinyl)-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]-3-pyridinecarboxamide IUPAC Name: 2-pyrrolidin-1-yl-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]pyridine-3-carboxamide Traditional Name: 2-pyrrolidino-N-[4-(1,2,4-triazol-1-ylmethyl)benzyl]nicotinamide Formula: C20H22N6O MolecularWeight: 362.42828

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=CC=N2)C(=O)NCC3=CC=C(C=C3)CN4C=NC=N4

Isomeric SMILES

C1CCN(C1)C2=C(C=CC=N2)C(=O)NCC3=CC=C(C=C3)CN4C=NC=N4

InChI

InChI=1S/C20H22N6O/c27-20(18-4-3-9-22-19(18)25-10-1-2-11-25)23-12-16-5-7-17(8-6-16)13-26-15-21-14-24-26/h3-9,14-15H,1-2,10-13H2,(H,23,27)