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

Systemtic Name: 6-morpholin-4-yl-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]pyridine-3-carboxamide Openeye Name: 6-morpholino-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]pyridine-3-carboxamide CAS Name: 6-(4-morpholinyl)-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]-3-pyridinecarboxamide IUPAC Name: 6-morpholin-4-yl-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]pyridine-3-carboxamide Traditional Name: 6-morpholino-N-[4-(1,2,4-triazol-1-ylmethyl)benzyl]nicotinamide Formula: C20H22N6O2 MolecularWeight: 378.42768

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC=C(C=C2)C(=O)NCC3=CC=C(C=C3)CN4C=NC=N4

Isomeric SMILES

C1COCCN1C2=NC=C(C=C2)C(=O)NCC3=CC=C(C=C3)CN4C=NC=N4

InChI

InChI=1S/C20H22N6O2/c27-20(18-5-6-19(22-12-18)25-7-9-28-10-8-25)23-11-16-1-3-17(4-2-16)13-26-15-21-14-24-26/h1-6,12,14-15H,7-11,13H2,(H,23,27)