1-[5-azanyl-3-(benzotriazol-1-yl)-1,2,4-triazol-1-yl]ethanone

Systemtic Name: 1-[5-azanyl-3-(benzotriazol-1-yl)-1,2,4-triazol-1-yl]ethanone Openeye Name: 1-[5-amino-3-(benzotriazol-1-yl)-1,2,4-triazol-1-yl]ethanone CAS Name: 1-[5-amino-3-(1-benzotriazolyl)-1,2,4-triazol-1-yl]ethanone IUPAC Name: 1-[5-amino-3-(benzotriazol-1-yl)-1,2,4-triazol-1-yl]ethanone Traditional Name: 1-[5-amino-3-(benzotriazol-1-yl)-1,2,4-triazol-1-yl]ethanone Formula: C10H9N7O MolecularWeight: 243.22476

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(=NC(=N1)N2C3=CC=CC=C3N=N2)N

Isomeric SMILES

CC(=O)N1C(=NC(=N1)N2C3=CC=CC=C3N=N2)N

InChI

InChI=1S/C10H9N7O/c1-6(18)16-9(11)12-10(14-16)17-8-5-3-2-4-7(8)13-15-17/h2-5H,1H3,(H2,11,12,14)