4-[[5-methyl-4-(4-methyl-3-oxidanylidene-1,4-benzoxazin-6-yl)-1,3-thiazol-2-yl]sulfamoyl]benzoic acid

Systemtic Name: 4-[[5-methyl-4-(4-methyl-3-oxidanylidene-1,4-benzoxazin-6-yl)-1,3-thiazol-2-yl]sulfamoyl]benzoic acid Openeye Name: 4-[[5-methyl-4-(4-methyl-3-oxo-1,4-benzoxazin-6-yl)thiazol-2-yl]sulfamoyl]benzoic acid CAS Name: 4-[[5-methyl-4-(4-methyl-3-oxo-1,4-benzoxazin-6-yl)-2-thiazolyl]sulfamoyl]benzoic acid IUPAC Name: 4-[[5-methyl-4-(4-methyl-3-oxo-1,4-benzoxazin-6-yl)-1,3-thiazol-2-yl]sulfamoyl]benzoic acid Traditional Name: 4-[[4-(3-keto-4-methyl-1,4-benzoxazin-6-yl)-5-methyl-thiazol-2-yl]sulfamoyl]benzoic acid Formula: C20H17N3O6S2 MolecularWeight: 459.49548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)O)C3=CC4=C(C=C3)OCC(=O)N4C

Isomeric SMILES

CC1=C(N=C(S1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)O)C3=CC4=C(C=C3)OCC(=O)N4C

InChI

InChI=1S/C20H17N3O6S2/c1-11-18(13-5-8-16-15(9-13)23(2)17(24)10-29-16)21-20(30-11)22-31(27,28)14-6-3-12(4-7-14)19(25)26/h3-9H,10H2,1-2H3,(H,21,22)(H,25,26)