methyl 3-[(4-bromanyl-3-methyl-phenyl)sulfamoyl]-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 3-[(4-bromanyl-3-methyl-phenyl)sulfamoyl]-1-benzothiophene-2-carboxylate Openeye Name: methyl 3-[(4-bromo-3-methyl-phenyl)sulfamoyl]benzothiophene-2-carboxylate CAS Name: 3-[(4-bromo-3-methylphenyl)sulfamoyl]-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 3-[(4-bromo-3-methylphenyl)sulfamoyl]-1-benzothiophene-2-carboxylate Traditional Name: 3-[(4-bromo-3-methyl-phenyl)sulfamoyl]benzothiophene-2-carboxylic acid methyl ester Formula: C17H14BrNO4S2 MolecularWeight: 440.33136

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NS(=O)(=O)C2=C(SC3=CC=CC=C32)C(=O)OC)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NS(=O)(=O)C2=C(SC3=CC=CC=C32)C(=O)OC)Br

InChI

InChI=1S/C17H14BrNO4S2/c1-10-9-11(7-8-13(10)18)19-25(21,22)16-12-5-3-4-6-14(12)24-15(16)17(20)23-2/h3-9,19H,1-2H3