methyl 2-[(5-bromanyl-4,6-dimethyl-pyrimidin-2-yl)carbamoylsulfamoyl]benzoate

Systemtic Name: methyl 2-[(5-bromanyl-4,6-dimethyl-pyrimidin-2-yl)carbamoylsulfamoyl]benzoate Openeye Name: methyl 2-[(5-bromo-4,6-dimethyl-pyrimidin-2-yl)carbamoylsulfamoyl]benzoate CAS Name: 2-[[[(5-bromo-4,6-dimethyl-2-pyrimidinyl)amino]-oxomethyl]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 2-[(5-bromo-4,6-dimethylpyrimidin-2-yl)carbamoylsulfamoyl]benzoate Traditional Name: 2-[(5-bromo-4,6-dimethyl-pyrimidin-2-yl)carbamoylsulfamoyl]benzoic acid methyl ester Formula: C15H15BrN4O5S MolecularWeight: 443.2724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC)C)Br

Isomeric SMILES

CC1=C(C(=NC(=N1)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC)C)Br

InChI

InChI=1S/C15H15BrN4O5S/c1-8-12(16)9(2)18-14(17-8)19-15(22)20-26(23,24)11-7-5-4-6-10(11)13(21)25-3/h4-7H,1-3H3,(H2,17,18,19,20,22)