3,4-dimethyl-5-[[(4-methyl-2-morpholin-4-yl-1,3-thiazol-5-yl)carbonylamino]sulfamoyl]benzoic acid

Systemtic Name: 3,4-dimethyl-5-[[(4-methyl-2-morpholin-4-yl-1,3-thiazol-5-yl)carbonylamino]sulfamoyl]benzoic acid Openeye Name: 3,4-dimethyl-5-[[(4-methyl-2-morpholino-thiazole-5-carbonyl)amino]sulfamoyl]benzoic acid CAS Name: 3,4-dimethyl-5-[[[[4-methyl-2-(4-morpholinyl)-5-thiazolyl]-oxomethyl]amino]sulfamoyl]benzoic acid IUPAC Name: 3,4-dimethyl-5-[[(4-methyl-2-morpholin-4-yl-1,3-thiazole-5-carbonyl)amino]sulfamoyl]benzoic acid Traditional Name: 3,4-dimethyl-5-[[(4-methyl-2-morpholino-thiazole-5-carbonyl)amino]sulfamoyl]benzoic acid Formula: C18H22N4O6S2 MolecularWeight: 454.52048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(=O)O)S(=O)(=O)NNC(=O)C2=C(N=C(S2)N3CCOCC3)C)C

Isomeric SMILES

CC1=C(C(=CC(=C1)C(=O)O)S(=O)(=O)NNC(=O)C2=C(N=C(S2)N3CCOCC3)C)C

InChI

InChI=1S/C18H22N4O6S2/c1-10-8-13(17(24)25)9-14(11(10)2)30(26,27)21-20-16(23)15-12(3)19-18(29-15)22-4-6-28-7-5-22/h8-9,21H,4-7H2,1-3H3,(H,20,23)(H,24,25)