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

Systemtic Name: methyl 3-[[2-[(3-fluoranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-phenyl-sulfamoyl]thiophene-2-carboxylate Openeye Name: methyl 3-[[2-(3-fluoro-4-methyl-anilino)-2-oxo-ethyl]-phenyl-sulfamoyl]thiophene-2-carboxylate CAS Name: 3-[[2-(3-fluoro-4-methylanilino)-2-oxoethyl]-phenylsulfamoyl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[2-(3-fluoro-4-methylanilino)-2-oxoethyl]-phenylsulfamoyl]thiophene-2-carboxylate Traditional Name: 3-[[2-(3-fluoro-4-methyl-anilino)-2-keto-ethyl]-phenyl-sulfamoyl]thiophene-2-carboxylic acid methyl ester Formula: C21H19FN2O5S2 MolecularWeight: 462.514363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CN(C2=CC=CC=C2)S(=O)(=O)C3=C(SC=C3)C(=O)OC)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CN(C2=CC=CC=C2)S(=O)(=O)C3=C(SC=C3)C(=O)OC)F

InChI

InChI=1S/C21H19FN2O5S2/c1-14-8-9-15(12-17(14)22)23-19(25)13-24(16-6-4-3-5-7-16)31(27,28)18-10-11-30-20(18)21(26)29-2/h3-12H,13H2,1-2H3,(H,23,25)