2-(5-methyl-4-nitro-pyrazol-1-yl)-N-(2-sulfanylethyl)propanamide

Systemtic Name: 2-(5-methyl-4-nitro-pyrazol-1-yl)-N-(2-sulfanylethyl)propanamide Openeye Name: 2-(5-methyl-4-nitro-pyrazol-1-yl)-N-(2-sulfanylethyl)propanamide CAS Name: N-(2-mercaptoethyl)-2-(5-methyl-4-nitro-1-pyrazolyl)propanamide IUPAC Name: 2-(5-methyl-4-nitropyrazol-1-yl)-N-(2-sulfanylethyl)propanamide Traditional Name: N-(2-mercaptoethyl)-2-(5-methyl-4-nitro-pyrazol-1-yl)propionamide Formula: C9H14N4O3S MolecularWeight: 258.29746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C(C)C(=O)NCCS)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=NN1C(C)C(=O)NCCS)[N+](=O)[O-]

InChI

InChI=1S/C9H14N4O3S/c1-6-8(13(15)16)5-11-12(6)7(2)9(14)10-3-4-17/h5,7,17H,3-4H2,1-2H3,(H,10,14)