methyl 2-[(4,6-dimethylpyrimidin-2-yl)carbamoylsulfamoylmethyl]benzoate

Systemtic Name: methyl 2-[(4,6-dimethylpyrimidin-2-yl)carbamoylsulfamoylmethyl]benzoate Openeye Name: methyl 2-[(4,6-dimethylpyrimidin-2-yl)carbamoylsulfamoylmethyl]benzoate CAS Name: 2-[[[(4,6-dimethyl-2-pyrimidinyl)amino]-oxomethyl]sulfamoylmethyl]benzoic acid methyl ester IUPAC Name: methyl 2-[(4,6-dimethylpyrimidin-2-yl)carbamoylsulfamoylmethyl]benzoate Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)carbamoylsulfamoylmethyl]benzoic acid methyl ester Formula: C16H18N4O5S MolecularWeight: 378.40292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)CC2=CC=CC=C2C(=O)OC)C

Isomeric SMILES

CC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)CC2=CC=CC=C2C(=O)OC)C

InChI

InChI=1S/C16H18N4O5S/c1-10-8-11(2)18-15(17-10)19-16(22)20-26(23,24)9-12-6-4-5-7-13(12)14(21)25-3/h4-8H,9H2,1-3H3,(H2,17,18,19,20,22)