2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanamide

Systemtic Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanamide Openeye Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-(5-thioxo-1H-1,2,4-triazol-4-yl)acetamide CAS Name: 2-(3,5-dimethyl-4-nitro-1-pyrazolyl)-N-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)acetamide IUPAC Name: 2-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)acetamide Traditional Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-(5-thioxo-1H-1,2,4-triazol-4-yl)acetamide Formula: C9H11N7O3S MolecularWeight: 297.29374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NN2C=NNC2=S)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NN2C=NNC2=S)C)[N+](=O)[O-]

InChI

InChI=1S/C9H11N7O3S/c1-5-8(16(18)19)6(2)14(12-5)3-7(17)13-15-4-10-11-9(15)20/h4H,3H2,1-2H3,(H,11,20)(H,13,17)