2-[[2,6-bis(fluoranyl)-5-methylsulfonyl-pyrimidin-4-yl]amino]benzenesulfonic acid

Systemtic Name: 2-[[2,6-bis(fluoranyl)-5-methylsulfonyl-pyrimidin-4-yl]amino]benzenesulfonic acid Openeye Name: 2-[(2,6-difluoro-5-methylsulfonyl-pyrimidin-4-yl)amino]benzenesulfonic acid CAS Name: 2-[(2,6-difluoro-5-methylsulfonyl-4-pyrimidinyl)amino]benzenesulfonic acid IUPAC Name: 2-[(2,6-difluoro-5-methylsulfonylpyrimidin-4-yl)amino]benzenesulfonic acid Traditional Name: 2-[(2,6-difluoro-5-mesyl-pyrimidin-4-yl)amino]besylic acid Formula: C11H9F2N3O5S2 MolecularWeight: 365.333066

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(N=C(N=C1F)F)NC2=CC=CC=C2S(=O)(=O)O

Isomeric SMILES

CS(=O)(=O)C1=C(N=C(N=C1F)F)NC2=CC=CC=C2S(=O)(=O)O

InChI

InChI=1S/C11H9F2N3O5S2/c1-22(17,18)8-9(12)15-11(13)16-10(8)14-6-4-2-3-5-7(6)23(19,20)21/h2-5H,1H3,(H,14,15,16)(H,19,20,21)