4-[[5-[2-[(4-bromophenyl)amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-1,3-thiazol-2-yl]amino]benzenesulfonate

Systemtic Name: 4-[[5-[2-[(4-bromophenyl)amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-1,3-thiazol-2-yl]amino]benzenesulfonate Openeye Name: 4-[[5-[2-(4-bromoanilino)-2-oxo-ethyl]-4-oxo-thiazol-2-yl]amino]benzenesulfonate CAS Name: 4-[[5-[2-(4-bromoanilino)-2-oxoethyl]-4-oxo-2-thiazolyl]amino]benzenesulfonate IUPAC Name: 4-[[5-[2-(4-bromoanilino)-2-oxoethyl]-4-oxo-1,3-thiazol-2-yl]amino]benzenesulfonate Traditional Name: 4-[[5-[2-(4-bromoanilino)-2-keto-ethyl]-4-keto-2-thiazolin-2-yl]amino]besylate Formula: C17H13BrN3O5S2- MolecularWeight: 483.33622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC2=NC(=O)C(S2)CC(=O)NC3=CC=C(C=C3)Br)S(=O)(=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NC2=NC(=O)C(S2)CC(=O)NC3=CC=C(C=C3)Br)S(=O)(=O)[O-]

InChI

InChI=1S/C17H14BrN3O5S2/c18-10-1-3-11(4-2-10)19-15(22)9-14-16(23)21-17(27-14)20-12-5-7-13(8-6-12)28(24,25)26/h1-8,14H,9H2,(H,19,22)(H,20,21,23)(H,24,25,26)/p-1