6-[(4-chloranyl-6-methoxy-pyrimidin-2-yl)carbamoylsulfamoyl]-6-ethyl-cyclohexa-2,4-diene-1-carboxylic acid

Systemtic Name: 6-[(4-chloranyl-6-methoxy-pyrimidin-2-yl)carbamoylsulfamoyl]-6-ethyl-cyclohexa-2,4-diene-1-carboxylic acid Openeye Name: 6-[(4-chloro-6-methoxy-pyrimidin-2-yl)carbamoylsulfamoyl]-6-ethyl-cyclohexa-2,4-diene-1-carboxylic acid CAS Name: 6-[[[(4-chloro-6-methoxy-2-pyrimidinyl)amino]-oxomethyl]sulfamoyl]-6-ethyl-1-cyclohexa-2,4-dienecarboxylic acid IUPAC Name: 6-[(4-chloro-6-methoxypyrimidin-2-yl)carbamoylsulfamoyl]-6-ethylcyclohexa-2,4-diene-1-carboxylic acid Traditional Name: 6-[(4-chloro-6-methoxy-pyrimidin-2-yl)carbamoylsulfamoyl]-6-ethyl-cyclohexa-2,4-diene-1-carboxylic acid Formula: C15H17ClN4O6S MolecularWeight: 416.83668

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C=CC=CC1C(=O)O)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)Cl)OC

Isomeric SMILES

CCC1(C=CC=CC1C(=O)O)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)Cl)OC

InChI

InChI=1S/C15H17ClN4O6S/c1-3-15(7-5-4-6-9(15)12(21)22)27(24,25)20-14(23)19-13-17-10(16)8-11(18-13)26-2/h4-9H,3H2,1-2H3,(H,21,22)(H2,17,18,19,20,23)