3-azanyl-N-[(E)-1,3-benzodioxol-4-ylmethylideneamino]-1H-1,2,4-triazole-5-carboxamide

Systemtic Name: 3-azanyl-N-[(E)-1,3-benzodioxol-4-ylmethylideneamino]-1H-1,2,4-triazole-5-carboxamide Openeye Name: 3-amino-N-[(E)-1,3-benzodioxol-4-ylmethyleneamino]-1H-1,2,4-triazole-5-carboxamide CAS Name: 3-amino-N-[(E)-1,3-benzodioxol-4-ylmethylideneamino]-1H-1,2,4-triazole-5-carboxamide IUPAC Name: 3-amino-N-[(E)-1,3-benzodioxol-4-ylmethylideneamino]-1H-1,2,4-triazole-5-carboxamide Traditional Name: 3-amino-N-[(E)-1,3-benzodioxol-4-ylmethyleneamino]-1H-1,2,4-triazole-5-carboxamide Formula: C11H10N6O3 MolecularWeight: 274.2355

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=CC=CC(=C2O1)C=NNC(=O)C3=NC(=NN3)N

Isomeric SMILES

C1OC2=CC=CC(=C2O1)/C=N/NC(=O)C3=NC(=NN3)N

InChI

InChI=1S/C11H10N6O3/c12-11-14-9(15-17-11)10(18)16-13-4-6-2-1-3-7-8(6)20-5-19-7/h1-4H,5H2,(H,16,18)(H3,12,14,15,17)/b13-4+