2-methyl-3-(4-nitropyrazol-1-yl)-N-(2-sulfanylethyl)propanamide

Systemtic Name: 2-methyl-3-(4-nitropyrazol-1-yl)-N-(2-sulfanylethyl)propanamide Openeye Name: 2-methyl-3-(4-nitropyrazol-1-yl)-N-(2-sulfanylethyl)propanamide CAS Name: N-(2-mercaptoethyl)-2-methyl-3-(4-nitro-1-pyrazolyl)propanamide IUPAC Name: 2-methyl-3-(4-nitropyrazol-1-yl)-N-(2-sulfanylethyl)propanamide Traditional Name: N-(2-mercaptoethyl)-2-methyl-3-(4-nitropyrazol-1-yl)propionamide Formula: C9H14N4O3S MolecularWeight: 258.29746

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C=C(C=N1)[N+](=O)[O-])C(=O)NCCS

Isomeric SMILES

CC(CN1C=C(C=N1)[N+](=O)[O-])C(=O)NCCS

InChI

InChI=1S/C9H14N4O3S/c1-7(9(14)10-2-3-17)5-12-6-8(4-11-12)13(15)16/h4,6-7,17H,2-3,5H2,1H3,(H,10,14)