methyl 5-tert-butyl-3-[[3-(trifluoromethyl)phenyl]sulfonylamino]thiophene-2-carboxylate

Systemtic Name: methyl 5-tert-butyl-3-[[3-(trifluoromethyl)phenyl]sulfonylamino]thiophene-2-carboxylate Openeye Name: methyl 5-tert-butyl-3-[[3-(trifluoromethyl)phenyl]sulfonylamino]thiophene-2-carboxylate CAS Name: 5-tert-butyl-3-[[3-(trifluoromethyl)phenyl]sulfonylamino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-tert-butyl-3-[[3-(trifluoromethyl)phenyl]sulfonylamino]thiophene-2-carboxylate Traditional Name: 5-tert-butyl-3-[[3-(trifluoromethyl)phenyl]sulfonylamino]thiophene-2-carboxylic acid methyl ester Formula: C17H18F3NO4S2 MolecularWeight: 421.45433

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(S1)C(=O)OC)NS(=O)(=O)C2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

CC(C)(C)C1=CC(=C(S1)C(=O)OC)NS(=O)(=O)C2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C17H18F3NO4S2/c1-16(2,3)13-9-12(14(26-13)15(22)25-4)21-27(23,24)11-7-5-6-10(8-11)17(18,19)20/h5-9,21H,1-4H3