methyl 3-[[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]-phenyl-sulfamoyl]thiophene-2-carboxylate

Systemtic Name: methyl 3-[[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]-phenyl-sulfamoyl]thiophene-2-carboxylate Openeye Name: methyl 3-[[2-(4-fluoroanilino)-2-oxo-ethyl]-phenyl-sulfamoyl]thiophene-2-carboxylate CAS Name: 3-[[2-(4-fluoroanilino)-2-oxoethyl]-phenylsulfamoyl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[2-(4-fluoroanilino)-2-oxoethyl]-phenylsulfamoyl]thiophene-2-carboxylate Traditional Name: 3-[[2-(4-fluoroanilino)-2-keto-ethyl]-phenyl-sulfamoyl]thiophene-2-carboxylic acid methyl ester Formula: C20H17FN2O5S2 MolecularWeight: 448.487783

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)S(=O)(=O)N(CC(=O)NC2=CC=C(C=C2)F)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=C(C=CS1)S(=O)(=O)N(CC(=O)NC2=CC=C(C=C2)F)C3=CC=CC=C3

InChI

InChI=1S/C20H17FN2O5S2/c1-28-20(25)19-17(11-12-29-19)30(26,27)23(16-5-3-2-4-6-16)13-18(24)22-15-9-7-14(21)8-10-15/h2-12H,13H2,1H3,(H,22,24)