5-[3-(phenylmethyl)-1,2,3-triazolidin-1-ium-1-ylidene]imidazole-4-carboxamide

Systemtic Name: 5-[3-(phenylmethyl)-1,2,3-triazolidin-1-ium-1-ylidene]imidazole-4-carboxamide Openeye Name: 5-(3-benzyltriazolidin-1-ium-1-ylidene)imidazole-4-carboxamide CAS Name: 5-[3-(phenylmethyl)-1-triazolidin-1-iumylidene]-4-imidazolecarboxamide IUPAC Name: 5-(3-benzyltriazolidin-1-ium-1-ylidene)imidazole-4-carboxamide Traditional Name: 5-(3-benzyltriazolidin-1-ium-1-ylidene)imidazole-4-carboxamide Formula: C13H15N6O+ MolecularWeight: 271.2978

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](=C2C(=NC=N2)C(=O)N)NN1CC3=CC=CC=C3

Isomeric SMILES

C1C[N+](=C2C(=NC=N2)C(=O)N)NN1CC3=CC=CC=C3

InChI

InChI=1S/C13H14N6O/c14-12(20)11-13(16-9-15-11)19-7-6-18(17-19)8-10-4-2-1-3-5-10/h1-5,9H,6-8H2,(H2-,14,15,16,17,20)/p+1