(5E)-5-(3-phenyl-1,2,3-triazolidin-1-ium-1-ylidene)imidazole-4-carboxamide chloride

Systemtic Name: (5E)-5-(3-phenyl-1,2,3-triazolidin-1-ium-1-ylidene)imidazole-4-carboxamide chloride Openeye Name: (5E)-5-(3-phenyltriazolidin-1-ium-1-ylidene)imidazole-4-carboxamide chloride CAS Name: (5E)-5-(3-phenyl-1-triazolidin-1-iumylidene)-4-imidazolecarboxamide chloride IUPAC Name: (5E)-5-(3-phenyltriazolidin-1-ium-1-ylidene)imidazole-4-carboxamide chloride Traditional Name: (5E)-5-(3-phenyltriazolidin-1-ium-1-ylidene)imidazole-4-carboxamide chloride Formula: C12H13ClN6O MolecularWeight: 292.72422

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](=C2C(=NC=N2)C(=O)N)NN1C3=CC=CC=C3.[Cl-]

Isomeric SMILES

C1C/[N+](=C\2/C(=NC=N2)C(=O)N)/NN1C3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C12H12N6O.ClH/c13-11(19)10-12(15-8-14-10)18-7-6-17(16-18)9-4-2-1-3-5-9;/h1-5,8H,6-7H2,(H2-,13,14,15,16,19);1H