methyl 5-nitro-6-[2-[[3-(trifluoromethyl)phenyl]sulfonylamino]phenyl]sulfanyl-pyridine-3-carboxylate

Systemtic Name: methyl 5-nitro-6-[2-[[3-(trifluoromethyl)phenyl]sulfonylamino]phenyl]sulfanyl-pyridine-3-carboxylate Openeye Name: methyl 5-nitro-6-[2-[[3-(trifluoromethyl)phenyl]sulfonylamino]phenyl]sulfanyl-pyridine-3-carboxylate CAS Name: 5-nitro-6-[[2-[[3-(trifluoromethyl)phenyl]sulfonylamino]phenyl]thio]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-nitro-6-[2-[[3-(trifluoromethyl)phenyl]sulfonylamino]phenyl]sulfanylpyridine-3-carboxylate Traditional Name: 5-nitro-6-[[2-[[3-(trifluoromethyl)phenyl]sulfonylamino]phenyl]thio]nicotinic acid methyl ester Formula: C20H14F3N3O6S2 MolecularWeight: 513.46687

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(N=C1)SC2=CC=CC=C2NS(=O)(=O)C3=CC=CC(=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=C(N=C1)SC2=CC=CC=C2NS(=O)(=O)C3=CC=CC(=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C20H14F3N3O6S2/c1-32-19(27)12-9-16(26(28)29)18(24-11-12)33-17-8-3-2-7-15(17)25-34(30,31)14-6-4-5-13(10-14)20(21,22)23/h2-11,25H,1H3