2-aminocarbonyl-3-(4-chloranyl-6-methoxy-pyrimidin-2-yl)-6-sulfamoyl-benzoic acid

Systemtic Name: 2-aminocarbonyl-3-(4-chloranyl-6-methoxy-pyrimidin-2-yl)-6-sulfamoyl-benzoic acid Openeye Name: 2-carbamoyl-3-(4-chloro-6-methoxy-pyrimidin-2-yl)-6-sulfamoyl-benzoic acid CAS Name: 2-carbamoyl-3-(4-chloro-6-methoxy-2-pyrimidinyl)-6-sulfamoylbenzoic acid IUPAC Name: 2-carbamoyl-3-(4-chloro-6-methoxypyrimidin-2-yl)-6-sulfamoylbenzoic acid Traditional Name: 2-carbamoyl-3-(4-chloro-6-methoxy-pyrimidin-2-yl)-6-sulfamoyl-benzoic acid Formula: C13H11ClN4O6S MolecularWeight: 386.76764

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)C2=C(C(=C(C=C2)S(=O)(=O)N)C(=O)O)C(=O)N)Cl

Isomeric SMILES

COC1=CC(=NC(=N1)C2=C(C(=C(C=C2)S(=O)(=O)N)C(=O)O)C(=O)N)Cl

InChI

InChI=1S/C13H11ClN4O6S/c1-24-8-4-7(14)17-12(18-8)5-2-3-6(25(16,22)23)10(13(20)21)9(5)11(15)19/h2-4H,1H3,(H2,15,19)(H,20,21)(H2,16,22,23)