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

Systemtic Name: methyl 3-[(4,6-dimethoxy-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylate Openeye Name: methyl 3-[(4,6-dimethoxy-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylate CAS Name: 3-[[[(4,6-dimethoxy-1,3,5-triazin-2-yl)amino]-oxomethyl]sulfamoyl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[(4,6-dimethoxy-1,3,5-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylate Traditional Name: 3-[(4,6-dimethoxy-s-triazin-2-yl)carbamoylsulfamoyl]thiophene-2-carboxylic acid methyl ester Formula: C12H13N5O7S2 MolecularWeight: 403.39092

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13N5O7S2/c1-22-8(18)7-6(4-5-25-7)26(20,21)17-10(19)13-9-14-11(23-2)16-12(15-9)24-3/h4-5H,1-3H3,(H2,13,14,15,16,17,19)