methyl 2-[(4,6-dimethoxy-1,3,5-triazin-2-yl)carbamoylsulfamoyl]cyclopentene-1-carboxylate

Systemtic Name: methyl 2-[(4,6-dimethoxy-1,3,5-triazin-2-yl)carbamoylsulfamoyl]cyclopentene-1-carboxylate Openeye Name: methyl 2-[(4,6-dimethoxy-1,3,5-triazin-2-yl)carbamoylsulfamoyl]cyclopentene-1-carboxylate CAS Name: 2-[[[(4,6-dimethoxy-1,3,5-triazin-2-yl)amino]-oxomethyl]sulfamoyl]-1-cyclopentenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(4,6-dimethoxy-1,3,5-triazin-2-yl)carbamoylsulfamoyl]cyclopentene-1-carboxylate Traditional Name: 2-[(4,6-dimethoxy-s-triazin-2-yl)carbamoylsulfamoyl]cyclopentene-1-carboxylic acid methyl ester Formula: C13H17N5O7S MolecularWeight: 387.36838

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC(=N1)NC(=O)NS(=O)(=O)C2=C(CCC2)C(=O)OC)OC

Isomeric SMILES

COC1=NC(=NC(=N1)NC(=O)NS(=O)(=O)C2=C(CCC2)C(=O)OC)OC

InChI

InChI=1S/C13H17N5O7S/c1-23-9(19)7-5-4-6-8(7)26(21,22)18-11(20)14-10-15-12(24-2)17-13(16-10)25-3/h4-6H2,1-3H3,(H2,14,15,16,17,18,20)