N-(1,3-benzodioxol-5-ylmethyl)-3-bromanyl-6-(1,2,4-triazol-4-yl)pyridine-2-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-bromanyl-6-(1,2,4-triazol-4-yl)pyridine-2-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-bromo-6-(1,2,4-triazol-4-yl)pyridine-2-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-bromo-6-(1,2,4-triazol-4-yl)-2-pyridinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-bromo-6-(1,2,4-triazol-4-yl)pyridine-2-carboxamide Traditional Name: 3-bromo-N-piperonyl-6-(1,2,4-triazol-4-yl)picolinamide Formula: C16H12BrN5O3 MolecularWeight: 402.20218

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=C(C=CC(=N3)N4C=NN=C4)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=C(C=CC(=N3)N4C=NN=C4)Br

InChI

InChI=1S/C16H12BrN5O3/c17-11-2-4-14(22-7-19-20-8-22)21-15(11)16(23)18-6-10-1-3-12-13(5-10)25-9-24-12/h1-5,7-8H,6,9H2,(H,18,23)