[2-[(5-bromanyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl] 2-oxidanyl-4-(thiophen-2-ylsulfonylamino)benzoate

Systemtic Name: [2-[(5-bromanyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl] 2-oxidanyl-4-(thiophen-2-ylsulfonylamino)benzoate Openeye Name: [2-[(5-bromothiazol-2-yl)amino]-2-oxo-ethyl] 2-hydroxy-4-(2-thienylsulfonylamino)benzoate CAS Name: 2-hydroxy-4-(thiophen-2-ylsulfonylamino)benzoic acid [2-[(5-bromo-2-thiazolyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(5-bromo-1,3-thiazol-2-yl)amino]-2-oxoethyl] 2-hydroxy-4-(thiophen-2-ylsulfonylamino)benzoate Traditional Name: 2-hydroxy-4-(2-thienylsulfonylamino)benzoic acid [2-[(5-bromothiazol-2-yl)amino]-2-keto-ethyl] ester Formula: C16H12BrN3O6S3 MolecularWeight: 518.38198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)S(=O)(=O)NC2=CC(=C(C=C2)C(=O)OCC(=O)NC3=NC=C(S3)Br)O

Isomeric SMILES

C1=CSC(=C1)S(=O)(=O)NC2=CC(=C(C=C2)C(=O)OCC(=O)NC3=NC=C(S3)Br)O

InChI

InChI=1S/C16H12BrN3O6S3/c17-12-7-18-16(28-12)19-13(22)8-26-15(23)10-4-3-9(6-11(10)21)20-29(24,25)14-2-1-5-27-14/h1-7,20-21H,8H2,(H,18,19,22)