4-[[4-(4,5-dihydro-1,3-thiazol-2-ylsulfamoyl)phenyl]carbamoyl]benzoic acid

Systemtic Name: 4-[[4-(4,5-dihydro-1,3-thiazol-2-ylsulfamoyl)phenyl]carbamoyl]benzoic acid Openeye Name: 4-[[4-(4,5-dihydrothiazol-2-ylsulfamoyl)phenyl]carbamoyl]benzoic acid CAS Name: 4-[[4-(4,5-dihydrothiazol-2-ylsulfamoyl)anilino]-oxomethyl]benzoic acid IUPAC Name: 4-[[4-(4,5-dihydro-1,3-thiazol-2-ylsulfamoyl)phenyl]carbamoyl]benzoic acid Traditional Name: 4-[[4-(2-thiazolin-2-ylsulfamoyl)phenyl]carbamoyl]benzoic acid Formula: C17H15N3O5S2 MolecularWeight: 405.4481

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CSC(=N1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1CSC(=N1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C17H15N3O5S2/c21-15(11-1-3-12(4-2-11)16(22)23)19-13-5-7-14(8-6-13)27(24,25)20-17-18-9-10-26-17/h1-8H,9-10H2,(H,18,20)(H,19,21)(H,22,23)