2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)sulfanyl]-N-[4-(trifluoromethyloxy)phenyl]ethanamide

Systemtic Name: 2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)sulfanyl]-N-[4-(trifluoromethyloxy)phenyl]ethanamide Openeye Name: 2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)sulfanyl]-N-[4-(trifluoromethoxy)phenyl]acetamide CAS Name: 2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)thio]-N-[4-(trifluoromethoxy)phenyl]acetamide IUPAC Name: 2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)sulfanyl]-N-[4-(trifluoromethoxy)phenyl]acetamide Traditional Name: 2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)thio]-N-[4-(trifluoromethoxy)phenyl]acetamide Formula: C13H11F3N4O4S MolecularWeight: 376.31105

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)SCC(=O)NC2=CC=C(C=C2)OC(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1)SCC(=O)NC2=CC=C(C=C2)OC(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C13H11F3N4O4S/c1-7-11(20(22)23)12(19-18-7)25-6-10(21)17-8-2-4-9(5-3-8)24-13(14,15)16/h2-5H,6H2,1H3,(H,17,21)(H,18,19)