2-(5-methyl-3-nitro-pyrazol-1-yl)-N-(2-sulfanylethyl)butanamide

Systemtic Name: 2-(5-methyl-3-nitro-pyrazol-1-yl)-N-(2-sulfanylethyl)butanamide Openeye Name: 2-(5-methyl-3-nitro-pyrazol-1-yl)-N-(2-sulfanylethyl)butanamide CAS Name: N-(2-mercaptoethyl)-2-(5-methyl-3-nitro-1-pyrazolyl)butanamide IUPAC Name: 2-(5-methyl-3-nitropyrazol-1-yl)-N-(2-sulfanylethyl)butanamide Traditional Name: N-(2-mercaptoethyl)-2-(5-methyl-3-nitro-pyrazol-1-yl)butyramide Formula: C10H16N4O3S MolecularWeight: 272.32404

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCCS)N1C(=CC(=N1)[N+](=O)[O-])C

Isomeric SMILES

CCC(C(=O)NCCS)N1C(=CC(=N1)[N+](=O)[O-])C

InChI

InChI=1S/C10H16N4O3S/c1-3-8(10(15)11-4-5-18)13-7(2)6-9(12-13)14(16)17/h6,8,18H,3-5H2,1-2H3,(H,11,15)