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

Systemtic Name: methyl 2-[(4-butoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate Openeye Name: methyl 2-[(4-butoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate CAS Name: 2-[[[(4-butoxy-6-methyl-1,3,5-triazin-2-yl)amino]-oxomethyl]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 2-[(4-butoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate Traditional Name: 2-[(4-butoxy-6-methyl-s-triazin-2-yl)carbamoylsulfamoyl]benzoic acid methyl ester Formula: C17H21N5O6S MolecularWeight: 423.44354

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=NC(=NC(=N1)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC)C

Isomeric SMILES

CCCCOC1=NC(=NC(=N1)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC)C

InChI

InChI=1S/C17H21N5O6S/c1-4-5-10-28-17-19-11(2)18-15(21-17)20-16(24)22-29(25,26)13-9-7-6-8-12(13)14(23)27-3/h6-9H,4-5,10H2,1-3H3,(H2,18,19,20,21,22,24)