[4-[5-propyl-4-[[(E)-pyridin-4-ylmethylideneamino]carbamoyl]-1,2,3-triazol-1-yl]-1,2,5-oxadiazol-3-yl]azanium chloride

Systemtic Name: [4-[5-propyl-4-[[(E)-pyridin-4-ylmethylideneamino]carbamoyl]-1,2,3-triazol-1-yl]-1,2,5-oxadiazol-3-yl]azanium chloride Openeye Name: [4-[5-propyl-4-[[(E)-4-pyridylmethyleneamino]carbamoyl]triazol-1-yl]-1,2,5-oxadiazol-3-yl]ammonium chloride CAS Name: [4-[4-[oxo-[(2E)-2-(pyridin-4-ylmethylidene)hydrazinyl]methyl]-5-propyl-1-triazolyl]-1,2,5-oxadiazol-3-yl]ammonium chloride IUPAC Name: [4-[5-propyl-4-[[(E)-pyridin-4-ylmethylideneamino]carbamoyl]triazol-1-yl]-1,2,5-oxadiazol-3-yl]azanium chloride Traditional Name: [4-[5-propyl-4-[[(E)-4-pyridylmethyleneamino]carbamoyl]triazol-1-yl]furazan-3-yl]ammonium chloride Formula: C14H16ClN9O2 MolecularWeight: 377.78894

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(N=NN1C2=NON=C2[NH3+])C(=O)NN=CC3=CC=NC=C3.[Cl-]

Isomeric SMILES

CCCC1=C(N=NN1C2=NON=C2[NH3+])C(=O)N/N=C/C3=CC=NC=C3.[Cl-]

InChI

InChI=1S/C14H15N9O2.ClH/c1-2-3-10-11(18-22-23(10)13-12(15)20-25-21-13)14(24)19-17-8-9-4-6-16-7-5-9;/h4-8H,2-3H2,1H3,(H2,15,20)(H,19,24);1H/b17-8+;