4-(4-nitrobutyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(4-nitrobutyl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-(4-nitrobutyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-(4-nitrobutyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(4-nitrobutyl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-(4-nitrobutyl)-1H-1,2,4-triazole-5-thione Formula: C6H10N4O2S MolecularWeight: 202.2342

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Descriptors Computed from Structure

Canonical SMILES:

C1=NNC(=S)N1CCCC[N+](=O)[O-]

Isomeric SMILES

C1=NNC(=S)N1CCCC[N+](=O)[O-]

InChI

InChI=1S/C6H10N4O2S/c11-10(12)4-2-1-3-9-5-7-8-6(9)13/h5H,1-4H2,(H,8,13)