2-(4-bromanyl-3-nitro-pyrazol-1-yl)-N-(3-methylsulfanylphenyl)ethanamide

Systemtic Name: 2-(4-bromanyl-3-nitro-pyrazol-1-yl)-N-(3-methylsulfanylphenyl)ethanamide Openeye Name: 2-(4-bromo-3-nitro-pyrazol-1-yl)-N-(3-methylsulfanylphenyl)acetamide CAS Name: 2-(4-bromo-3-nitro-1-pyrazolyl)-N-[3-(methylthio)phenyl]acetamide IUPAC Name: 2-(4-bromo-3-nitropyrazol-1-yl)-N-(3-methylsulfanylphenyl)acetamide Traditional Name: 2-(4-bromo-3-nitro-pyrazol-1-yl)-N-[3-(methylthio)phenyl]acetamide Formula: C12H11BrN4O3S MolecularWeight: 371.20974

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NC(=O)CN2C=C(C(=N2)[N+](=O)[O-])Br

Isomeric SMILES

CSC1=CC=CC(=C1)NC(=O)CN2C=C(C(=N2)[N+](=O)[O-])Br

InChI

InChI=1S/C12H11BrN4O3S/c1-21-9-4-2-3-8(5-9)14-11(18)7-16-6-10(13)12(15-16)17(19)20/h2-6H,7H2,1H3,(H,14,18)