N-(4-fluoranyl-6-methoxy-pyrimidin-2-yl)-2-methylsulfonyl-3-sulfamoyl-benzamide

Systemtic Name: N-(4-fluoranyl-6-methoxy-pyrimidin-2-yl)-2-methylsulfonyl-3-sulfamoyl-benzamide Openeye Name: N-(4-fluoro-6-methoxy-pyrimidin-2-yl)-2-methylsulfonyl-3-sulfamoyl-benzamide CAS Name: N-(4-fluoro-6-methoxy-2-pyrimidinyl)-2-methylsulfonyl-3-sulfamoylbenzamide IUPAC Name: N-(4-fluoro-6-methoxypyrimidin-2-yl)-2-methylsulfonyl-3-sulfamoylbenzamide Traditional Name: N-(4-fluoro-6-methoxy-pyrimidin-2-yl)-2-mesyl-3-sulfamoyl-benzamide Formula: C13H13FN4O6S2 MolecularWeight: 404.393923

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13FN4O6S2/c1-24-10-6-9(14)16-13(17-10)18-12(19)7-4-3-5-8(26(15,22)23)11(7)25(2,20)21/h3-6H,1-2H3,(H2,15,22,23)(H,16,17,18,19)