2-(3-nitrophenyl)-1H-1,2,4-triazole-3-thione

Systemtic Name: 2-(3-nitrophenyl)-1H-1,2,4-triazole-3-thione Openeye Name: 2-(3-nitrophenyl)-1H-1,2,4-triazole-3-thione CAS Name: 2-(3-nitrophenyl)-1H-1,2,4-triazole-3-thione IUPAC Name: 2-(3-nitrophenyl)-1H-1,2,4-triazole-3-thione Traditional Name: 2-(3-nitrophenyl)-1H-1,2,4-triazole-3-thione Formula: C8H6N4O2S MolecularWeight: 222.22384

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])N2C(=S)N=CN2

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])N2C(=S)N=CN2

InChI

InChI=1S/C8H6N4O2S/c13-12(14)7-3-1-2-6(4-7)11-8(15)9-5-10-11/h1-5H,(H,9,10,15)