3-[(4-methoxy-6-methyl-pyrimidin-2-yl)carbamoylsulfamoyl]-1-methyl-indole-2-carboxylic acid

Systemtic Name: 3-[(4-methoxy-6-methyl-pyrimidin-2-yl)carbamoylsulfamoyl]-1-methyl-indole-2-carboxylic acid Openeye Name: 3-[(4-methoxy-6-methyl-pyrimidin-2-yl)carbamoylsulfamoyl]-1-methyl-indole-2-carboxylic acid CAS Name: 3-[[[(4-methoxy-6-methyl-2-pyrimidinyl)amino]-oxomethyl]sulfamoyl]-1-methyl-2-indolecarboxylic acid IUPAC Name: 3-[(4-methoxy-6-methylpyrimidin-2-yl)carbamoylsulfamoyl]-1-methylindole-2-carboxylic acid Traditional Name: 3-[(4-methoxy-6-methyl-pyrimidin-2-yl)carbamoylsulfamoyl]-1-methyl-indole-2-carboxylic acid Formula: C17H17N5O6S MolecularWeight: 419.41178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=C(N(C3=CC=CC=C32)C)C(=O)O)OC

Isomeric SMILES

CC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=C(N(C3=CC=CC=C32)C)C(=O)O)OC

InChI

InChI=1S/C17H17N5O6S/c1-9-8-12(28-3)19-16(18-9)20-17(25)21-29(26,27)14-10-6-4-5-7-11(10)22(2)13(14)15(23)24/h4-8H,1-3H3,(H,23,24)(H2,18,19,20,21,25)