methyl 2-[(5-bromanylthiophen-2-yl)sulfonyl-methyl-amino]benzoate

Systemtic Name: methyl 2-[(5-bromanylthiophen-2-yl)sulfonyl-methyl-amino]benzoate Openeye Name: methyl 2-[(5-bromo-2-thienyl)sulfonyl-methyl-amino]benzoate CAS Name: 2-[(5-bromo-2-thiophenyl)sulfonyl-methylamino]benzoic acid methyl ester IUPAC Name: methyl 2-[(5-bromothiophen-2-yl)sulfonyl-methylamino]benzoate Traditional Name: 2-[(5-bromo-2-thienyl)sulfonyl-methyl-amino]benzoic acid methyl ester Formula: C13H12BrNO4S2 MolecularWeight: 390.27268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1C(=O)OC)S(=O)(=O)C2=CC=C(S2)Br

Isomeric SMILES

CN(C1=CC=CC=C1C(=O)OC)S(=O)(=O)C2=CC=C(S2)Br

InChI

InChI=1S/C13H12BrNO4S2/c1-15(21(17,18)12-8-7-11(14)20-12)10-6-4-3-5-9(10)13(16)19-2/h3-8H,1-2H3