ethyl 2-aminocarbonyl-3-(6-chloranyl-4-oxidanylidene-1H-pyrimidin-2-yl)-6-sulfamoyl-benzoate

Systemtic Name: ethyl 2-aminocarbonyl-3-(6-chloranyl-4-oxidanylidene-1H-pyrimidin-2-yl)-6-sulfamoyl-benzoate Openeye Name: ethyl 2-carbamoyl-3-(6-chloro-4-oxo-1H-pyrimidin-2-yl)-6-sulfamoyl-benzoate CAS Name: 2-carbamoyl-3-(6-chloro-4-oxo-1H-pyrimidin-2-yl)-6-sulfamoylbenzoic acid ethyl ester IUPAC Name: ethyl 2-carbamoyl-3-(6-chloro-4-oxo-1H-pyrimidin-2-yl)-6-sulfamoylbenzoate Traditional Name: 2-carbamoyl-3-(6-chloro-4-keto-1H-pyrimidin-2-yl)-6-sulfamoyl-benzoic acid ethyl ester Formula: C14H13ClN4O6S MolecularWeight: 400.79422

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=CC(=C1C(=O)N)C2=NC(=O)C=C(N2)Cl)S(=O)(=O)N

Isomeric SMILES

CCOC(=O)C1=C(C=CC(=C1C(=O)N)C2=NC(=O)C=C(N2)Cl)S(=O)(=O)N

InChI

InChI=1S/C14H13ClN4O6S/c1-2-25-14(22)11-7(26(17,23)24)4-3-6(10(11)12(16)21)13-18-8(15)5-9(20)19-13/h3-5H,2H2,1H3,(H2,16,21)(H2,17,23,24)(H,18,19,20)