2-(1,3-benzothiazol-2-yloxy)-N-methyl-N-phenyl-ethanamide; 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoylmethyl]benzoic acid

Systemtic Name: 2-(1,3-benzothiazol-2-yloxy)-N-methyl-N-phenyl-ethanamide; 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoylmethyl]benzoic acid Openeye Name: 2-(1,3-benzothiazol-2-yloxy)-N-methyl-N-phenyl-acetamide; 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoylmethyl]benzoic acid CAS Name: 2-(1,3-benzothiazol-2-yloxy)-N-methyl-N-phenylacetamide; 2-[[[(4,6-dimethoxy-2-pyrimidinyl)amino]-oxomethyl]sulfamoylmethyl]benzoic acid IUPAC Name: 2-(1,3-benzothiazol-2-yloxy)-N-methyl-N-phenylacetamide; 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoylmethyl]benzoic acid Traditional Name: 2-(1,3-benzothiazol-2-yloxy)-N-methyl-N-phenyl-acetamide; 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoylmethyl]benzoic acid Formula: C31H30N6O9S2 MolecularWeight: 694.7347

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1)C(=O)COC2=NC3=CC=CC=C3S2.COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)CC2=CC=CC=C2C(=O)O)OC

Isomeric SMILES

CN(C1=CC=CC=C1)C(=O)COC2=NC3=CC=CC=C3S2.COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)CC2=CC=CC=C2C(=O)O)OC

InChI

InChI=1S/C16H14N2O2S.C15H16N4O7S/c1-18(12-7-3-2-4-8-12)15(19)11-20-16-17-13-9-5-6-10-14(13)21-16;1-25-11-7-12(26-2)17-14(16-11)18-15(22)19-27(23,24)8-9-5-3-4-6-10(9)13(20)21/h2-10H,11H2,1H3;3-7H,8H2,1-2H3,(H,20,21)(H2,16,17,18,19,22)