2-(3-nitropyrazol-1-yl)-N-(2-sulfanylethyl)ethanamide

Systemtic Name: 2-(3-nitropyrazol-1-yl)-N-(2-sulfanylethyl)ethanamide Openeye Name: 2-(3-nitropyrazol-1-yl)-N-(2-sulfanylethyl)acetamide CAS Name: N-(2-mercaptoethyl)-2-(3-nitro-1-pyrazolyl)acetamide IUPAC Name: 2-(3-nitropyrazol-1-yl)-N-(2-sulfanylethyl)acetamide Traditional Name: N-(2-mercaptoethyl)-2-(3-nitropyrazol-1-yl)acetamide Formula: C7H10N4O3S MolecularWeight: 230.2443

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1[N+](=O)[O-])CC(=O)NCCS

Isomeric SMILES

C1=CN(N=C1[N+](=O)[O-])CC(=O)NCCS

InChI

InChI=1S/C7H10N4O3S/c12-7(8-2-4-15)5-10-3-1-6(9-10)11(13)14/h1,3,15H,2,4-5H2,(H,8,12)