2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-(2-sulfanylethyl)ethanamide

Systemtic Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-(2-sulfanylethyl)ethanamide Openeye Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-(2-sulfanylethyl)acetamide CAS Name: 2-(3,5-dimethyl-4-nitro-1-pyrazolyl)-N-(2-mercaptoethyl)acetamide IUPAC Name: 2-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-(2-sulfanylethyl)acetamide Traditional Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-(2-mercaptoethyl)acetamide Formula: C9H14N4O3S MolecularWeight: 258.29746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NCCS)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NCCS)C)[N+](=O)[O-]

InChI

InChI=1S/C9H14N4O3S/c1-6-9(13(15)16)7(2)12(11-6)5-8(14)10-3-4-17/h17H,3-5H2,1-2H3,(H,10,14)