3-(benzotriazol-1-ylmethyl)-4-[(Z)-(3-nitrophenyl)methylideneamino]-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-(benzotriazol-1-ylmethyl)-4-[(Z)-(3-nitrophenyl)methylideneamino]-1H-1,2,4-triazole-5-thione Openeye Name: 3-(benzotriazol-1-ylmethyl)-4-[(Z)-(3-nitrophenyl)methyleneamino]-1H-1,2,4-triazole-5-thione CAS Name: 3-(1-benzotriazolylmethyl)-4-[(Z)-(3-nitrophenyl)methylideneamino]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(benzotriazol-1-ylmethyl)-4-[(Z)-(3-nitrophenyl)methylideneamino]-1H-1,2,4-triazole-5-thione Traditional Name: 3-(benzotriazol-1-ylmethyl)-4-[(Z)-(3-nitrobenzylidene)amino]-1H-1,2,4-triazole-5-thione Formula: C16H12N8O2S MolecularWeight: 380.38388

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2CC3=NNC(=S)N3N=CC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2CC3=NNC(=S)N3/N=C\C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C16H12N8O2S/c25-24(26)12-5-3-4-11(8-12)9-17-23-15(19-20-16(23)27)10-22-14-7-2-1-6-13(14)18-21-22/h1-9H,10H2,(H,20,27)/b17-9-