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

Systemtic Name: N-(2-methylsulfanylphenyl)-2-(3-nitropyrazol-1-yl)ethanamide Openeye Name: N-(2-methylsulfanylphenyl)-2-(3-nitropyrazol-1-yl)acetamide CAS Name: N-[2-(methylthio)phenyl]-2-(3-nitro-1-pyrazolyl)acetamide IUPAC Name: N-(2-methylsulfanylphenyl)-2-(3-nitropyrazol-1-yl)acetamide Traditional Name: N-[2-(methylthio)phenyl]-2-(3-nitropyrazol-1-yl)acetamide Formula: C12H12N4O3S MolecularWeight: 292.31368

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1NC(=O)CN2C=CC(=N2)[N+](=O)[O-]

Isomeric SMILES

CSC1=CC=CC=C1NC(=O)CN2C=CC(=N2)[N+](=O)[O-]

InChI

InChI=1S/C12H12N4O3S/c1-20-10-5-3-2-4-9(10)13-12(17)8-15-7-6-11(14-15)16(18)19/h2-7H,8H2,1H3,(H,13,17)