[4-[(5-bromanyl-2-oxidanyl-phenyl)carbonylamino]phenyl]sulfonyl-(2,6-dimethoxypyrimidin-4-yl)azanide

Systemtic Name: [4-[(5-bromanyl-2-oxidanyl-phenyl)carbonylamino]phenyl]sulfonyl-(2,6-dimethoxypyrimidin-4-yl)azanide Openeye Name: [4-[(5-bromo-2-hydroxy-benzoyl)amino]phenyl]sulfonyl-(2,6-dimethoxypyrimidin-4-yl)azanide CAS Name: [4-[[(5-bromo-2-hydroxyphenyl)-oxomethyl]amino]phenyl]sulfonyl-(2,6-dimethoxy-4-pyrimidinyl)azanide IUPAC Name: [4-[(5-bromo-2-hydroxybenzoyl)amino]phenyl]sulfonyl-(2,6-dimethoxypyrimidin-4-yl)azanide Traditional Name: [4-[(5-bromo-2-hydroxy-benzoyl)amino]phenyl]sulfonyl-(2,6-dimethoxypyrimidin-4-yl)azanide Formula: C19H16BrN4O6S- MolecularWeight: 508.32254

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC(=C1)[N-]S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=C(C=CC(=C3)Br)O)OC

Isomeric SMILES

COC1=NC(=NC(=C1)[N-]S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=C(C=CC(=C3)Br)O)OC

InChI

InChI=1S/C19H17BrN4O6S/c1-29-17-10-16(22-19(23-17)30-2)24-31(27,28)13-6-4-12(5-7-13)21-18(26)14-9-11(20)3-8-15(14)25/h3-10H,1-2H3,(H3,21,22,23,24,25,26)/p-1