3-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-4-methyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-4-methyl-1H-1,2,4-triazole-5-thione Openeye Name: 3-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-4-methyl-1H-1,2,4-triazole-5-thione CAS Name: 3-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-4-methyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-4-methyl-1H-1,2,4-triazole-5-thione Traditional Name: 3-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-4-methyl-1H-1,2,4-triazole-5-thione Formula: C9H12N6O2S MolecularWeight: 268.29558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=NNC(=S)N2C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=NNC(=S)N2C)C)[N+](=O)[O-]

InChI

InChI=1S/C9H12N6O2S/c1-5-8(15(16)17)6(2)14(12-5)4-7-10-11-9(18)13(7)3/h4H2,1-3H3,(H,11,18)