ethyl 2-[(4,6-dimethylpyrimidin-2-yl)carbamoylsulfamoyl]-4-iodanyl-benzoate

Systemtic Name: ethyl 2-[(4,6-dimethylpyrimidin-2-yl)carbamoylsulfamoyl]-4-iodanyl-benzoate Openeye Name: ethyl 2-[(4,6-dimethylpyrimidin-2-yl)carbamoylsulfamoyl]-4-iodo-benzoate CAS Name: 2-[[[(4,6-dimethyl-2-pyrimidinyl)amino]-oxomethyl]sulfamoyl]-4-iodobenzoic acid ethyl ester IUPAC Name: ethyl 2-[(4,6-dimethylpyrimidin-2-yl)carbamoylsulfamoyl]-4-iodobenzoate Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)carbamoylsulfamoyl]-4-iodo-benzoic acid ethyl ester Formula: C16H17IN4O5S MolecularWeight: 504.29945

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(C=C1)I)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)C)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(C=C1)I)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)C)C

InChI

InChI=1S/C16H17IN4O5S/c1-4-26-14(22)12-6-5-11(17)8-13(12)27(24,25)21-16(23)20-15-18-9(2)7-10(3)19-15/h5-8H,4H2,1-3H3,(H2,18,19,20,21,23)