4-azanyl-3-(benzotriazol-1-ylmethyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-azanyl-3-(benzotriazol-1-ylmethyl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-amino-3-(benzotriazol-1-ylmethyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-amino-3-(1-benzotriazolylmethyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-amino-3-(benzotriazol-1-ylmethyl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-amino-3-(benzotriazol-1-ylmethyl)-1H-1,2,4-triazole-5-thione Formula: C9H9N7S MolecularWeight: 247.27966

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2CC3=NNC(=S)N3N

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2CC3=NNC(=S)N3N

InChI

InChI=1S/C9H9N7S/c10-16-8(12-13-9(16)17)5-15-7-4-2-1-3-6(7)11-14-15/h1-4H,5,10H2,(H,13,17)