2-chloroethyl 2-[(4,6-dimethylpyrimidin-2-yl)carbamoylsulfamoyloxy]benzoate

Systemtic Name: 2-chloroethyl 2-[(4,6-dimethylpyrimidin-2-yl)carbamoylsulfamoyloxy]benzoate Openeye Name: 2-chloroethyl 2-[(4,6-dimethylpyrimidin-2-yl)carbamoylsulfamoyloxy]benzoate CAS Name: 2-[[[(4,6-dimethyl-2-pyrimidinyl)amino]-oxomethyl]sulfamoyloxy]benzoic acid 2-chloroethyl ester IUPAC Name: 2-chloroethyl 2-[(4,6-dimethylpyrimidin-2-yl)carbamoylsulfamoyloxy]benzoate Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)carbamoylsulfamoyloxy]benzoic acid 2-chloroethyl ester Formula: C16H17ClN4O6S MolecularWeight: 428.84738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)OC2=CC=CC=C2C(=O)OCCCl)C

Isomeric SMILES

CC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)OC2=CC=CC=C2C(=O)OCCCl)C

InChI

InChI=1S/C16H17ClN4O6S/c1-10-9-11(2)19-15(18-10)20-16(23)21-28(24,25)27-13-6-4-3-5-12(13)14(22)26-8-7-17/h3-6,9H,7-8H2,1-2H3,(H2,18,19,20,21,23)