4-chloranyl-3-[[4-(2,5-dimethylphenyl)-1,3-thiazol-2-yl]sulfamoyl]benzoic acid

Systemtic Name: 4-chloranyl-3-[[4-(2,5-dimethylphenyl)-1,3-thiazol-2-yl]sulfamoyl]benzoic acid Openeye Name: 4-chloro-3-[[4-(2,5-dimethylphenyl)thiazol-2-yl]sulfamoyl]benzoic acid CAS Name: 4-chloro-3-[[4-(2,5-dimethylphenyl)-2-thiazolyl]sulfamoyl]benzoic acid IUPAC Name: 4-chloro-3-[[4-(2,5-dimethylphenyl)-1,3-thiazol-2-yl]sulfamoyl]benzoic acid Traditional Name: 4-chloro-3-[[4-(2,5-dimethylphenyl)thiazol-2-yl]sulfamoyl]benzoic acid Formula: C18H15ClN2O4S2 MolecularWeight: 422.9057

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C2=CSC(=N2)NS(=O)(=O)C3=C(C=CC(=C3)C(=O)O)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C)C2=CSC(=N2)NS(=O)(=O)C3=C(C=CC(=C3)C(=O)O)Cl

InChI

InChI=1S/C18H15ClN2O4S2/c1-10-3-4-11(2)13(7-10)15-9-26-18(20-15)21-27(24,25)16-8-12(17(22)23)5-6-14(16)19/h3-9H,1-2H3,(H,20,21)(H,22,23)