4-butyl-1H-1,2,4-triazole-5-thione; 1-nitroethane

Systemtic Name: 4-butyl-1H-1,2,4-triazole-5-thione; 1-nitroethane Openeye Name: 4-butyl-1H-1,2,4-triazole-5-thione; 1-nitroethane CAS Name: 4-butyl-1H-1,2,4-triazole-5-thione; 1-nitroethane IUPAC Name: 4-butyl-1H-1,2,4-triazole-5-thione; 1-nitroethane Traditional Name: 4-butyl-1H-1,2,4-triazole-5-thione; 1-nitroethane Formula: C8H16N4O2S MolecularWeight: 232.30324

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=NNC1=S.CC[N+](=O)[O-]

Isomeric SMILES

CCCCN1C=NNC1=S.CC[N+](=O)[O-]

InChI

InChI=1S/C6H11N3S.C2H5NO2/c1-2-3-4-9-5-7-8-6(9)10;1-2-3(4)5/h5H,2-4H2,1H3,(H,8,10);2H2,1H3