3-[(4,6-dimethoxy-1,3,5-triazin-2-yl)carbamoylsulfamoyl]-1-methyl-indole-2-carboxylic acid

Systemtic Name: 3-[(4,6-dimethoxy-1,3,5-triazin-2-yl)carbamoylsulfamoyl]-1-methyl-indole-2-carboxylic acid Openeye Name: 3-[(4,6-dimethoxy-1,3,5-triazin-2-yl)carbamoylsulfamoyl]-1-methyl-indole-2-carboxylic acid CAS Name: 3-[[[(4,6-dimethoxy-1,3,5-triazin-2-yl)amino]-oxomethyl]sulfamoyl]-1-methyl-2-indolecarboxylic acid IUPAC Name: 3-[(4,6-dimethoxy-1,3,5-triazin-2-yl)carbamoylsulfamoyl]-1-methylindole-2-carboxylic acid Traditional Name: 3-[(4,6-dimethoxy-s-triazin-2-yl)carbamoylsulfamoyl]-1-methyl-indole-2-carboxylic acid Formula: C16H16N6O7S MolecularWeight: 436.39924

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C1C(=O)O)S(=O)(=O)NC(=O)NC3=NC(=NC(=N3)OC)OC

Isomeric SMILES

CN1C2=CC=CC=C2C(=C1C(=O)O)S(=O)(=O)NC(=O)NC3=NC(=NC(=N3)OC)OC

InChI

InChI=1S/C16H16N6O7S/c1-22-9-7-5-4-6-8(9)11(10(22)12(23)24)30(26,27)21-14(25)17-13-18-15(28-2)20-16(19-13)29-3/h4-7H,1-3H3,(H,23,24)(H2,17,18,19,20,21,25)