N-[4-[5-(4-methylphenyl)-3-(trifluoromethyl)pyrazol-1-yl]phenyl]sulfonyl-2-nitro-ethanamide

Systemtic Name: N-[4-[5-(4-methylphenyl)-3-(trifluoromethyl)pyrazol-1-yl]phenyl]sulfonyl-2-nitro-ethanamide Openeye Name: 2-nitro-N-[4-[5-(p-tolyl)-3-(trifluoromethyl)pyrazol-1-yl]phenyl]sulfonyl-acetamide CAS Name: N-[4-[5-(4-methylphenyl)-3-(trifluoromethyl)-1-pyrazolyl]phenyl]sulfonyl-2-nitroacetamide IUPAC Name: N-[4-[5-(4-methylphenyl)-3-(trifluoromethyl)pyrazol-1-yl]phenyl]sulfonyl-2-nitroacetamide Traditional Name: 2-nitro-N-[4-[5-(p-tolyl)-3-(trifluoromethyl)pyrazol-1-yl]phenyl]sulfonyl-acetamide Formula: C19H15F3N4O5S MolecularWeight: 468.40641

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)S(=O)(=O)NC(=O)C[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)S(=O)(=O)NC(=O)C[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C19H15F3N4O5S/c1-12-2-4-13(5-3-12)16-10-17(19(20,21)22)23-26(16)14-6-8-15(9-7-14)32(30,31)24-18(27)11-25(28)29/h2-10H,11H2,1H3,(H,24,27)