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

Systemtic Name: 5-bromanyl-N-[[2-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]pyridine-3-carboxamide Openeye Name: 5-bromo-N-[[2-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]pyridine-3-carboxamide CAS Name: 5-bromo-N-[[2-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]-3-pyridinecarboxamide IUPAC Name: 5-bromo-N-[[2-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]pyridine-3-carboxamide Traditional Name: 5-bromo-N-[2-(1,2,4-triazol-1-ylmethyl)benzyl]nicotinamide Formula: C16H14BrN5O MolecularWeight: 372.21926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC(=O)C2=CC(=CN=C2)Br)CN3C=NC=N3

Isomeric SMILES

C1=CC=C(C(=C1)CNC(=O)C2=CC(=CN=C2)Br)CN3C=NC=N3

InChI

InChI=1S/C16H14BrN5O/c17-15-5-14(6-18-8-15)16(23)20-7-12-3-1-2-4-13(12)9-22-11-19-10-21-22/h1-6,8,10-11H,7,9H2,(H,20,23)