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

Systemtic Name: ethyl 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-4-iodanyl-benzoate Openeye Name: ethyl 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-4-iodo-benzoate CAS Name: 2-[[[(4,6-dimethoxy-2-pyrimidinyl)amino]-oxomethyl]sulfamoyl]-4-iodobenzoic acid ethyl ester IUPAC Name: ethyl 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-4-iodobenzoate Traditional Name: 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-4-iodo-benzoic acid ethyl ester Formula: C16H17IN4O7S MolecularWeight: 536.29825

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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)OC)OC

Isomeric SMILES

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

InChI

InChI=1S/C16H17IN4O7S/c1-4-28-14(22)10-6-5-9(17)7-11(10)29(24,25)21-16(23)20-15-18-12(26-2)8-13(19-15)27-3/h5-8H,4H2,1-3H3,(H2,18,19,20,21,23)