methyl 2-[[4-(methoxymethyl)-6-methylsulfanyl-1,3,5-triazin-2-yl]carbamoylsulfamoyl]benzoate

Systemtic Name: methyl 2-[[4-(methoxymethyl)-6-methylsulfanyl-1,3,5-triazin-2-yl]carbamoylsulfamoyl]benzoate Openeye Name: methyl 2-[[4-(methoxymethyl)-6-methylsulfanyl-1,3,5-triazin-2-yl]carbamoylsulfamoyl]benzoate CAS Name: 2-[[[[4-(methoxymethyl)-6-(methylthio)-1,3,5-triazin-2-yl]amino]-oxomethyl]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 2-[[4-(methoxymethyl)-6-methylsulfanyl-1,3,5-triazin-2-yl]carbamoylsulfamoyl]benzoate Traditional Name: 2-[[4-(methoxymethyl)-6-(methylthio)-s-triazin-2-yl]carbamoylsulfamoyl]benzoic acid methyl ester Formula: C15H17N5O6S2 MolecularWeight: 427.45538

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=NC(=NC(=N1)SC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC

Isomeric SMILES

COCC1=NC(=NC(=N1)SC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC

InChI

InChI=1S/C15H17N5O6S2/c1-25-8-11-16-13(19-15(17-11)27-3)18-14(22)20-28(23,24)10-7-5-4-6-9(10)12(21)26-2/h4-7H,8H2,1-3H3,(H2,16,17,18,19,20,22)