3-[4-[[(2-morpholin-4-yl-1,3-thiazol-4-yl)carbonylamino]sulfamoyl]phenyl]propanoic acid

Systemtic Name: 3-[4-[[(2-morpholin-4-yl-1,3-thiazol-4-yl)carbonylamino]sulfamoyl]phenyl]propanoic acid Openeye Name: 3-[4-[[(2-morpholinothiazole-4-carbonyl)amino]sulfamoyl]phenyl]propanoic acid CAS Name: 3-[4-[[[[2-(4-morpholinyl)-4-thiazolyl]-oxomethyl]amino]sulfamoyl]phenyl]propanoic acid IUPAC Name: 3-[4-[[(2-morpholin-4-yl-1,3-thiazole-4-carbonyl)amino]sulfamoyl]phenyl]propanoic acid Traditional Name: 3-[4-[[(2-morpholinothiazole-4-carbonyl)amino]sulfamoyl]phenyl]propionic acid Formula: C17H20N4O6S2 MolecularWeight: 440.4939

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC(=CS2)C(=O)NNS(=O)(=O)C3=CC=C(C=C3)CCC(=O)O

Isomeric SMILES

C1COCCN1C2=NC(=CS2)C(=O)NNS(=O)(=O)C3=CC=C(C=C3)CCC(=O)O

InChI

InChI=1S/C17H20N4O6S2/c22-15(23)6-3-12-1-4-13(5-2-12)29(25,26)20-19-16(24)14-11-28-17(18-14)21-7-9-27-10-8-21/h1-2,4-5,11,20H,3,6-10H2,(H,19,24)(H,22,23)