3-[[[2-(methylsulfonylamino)pyrimidin-4-yl]amino]methoxy]benzenesulfonic acid

Systemtic Name: 3-[[[2-(methylsulfonylamino)pyrimidin-4-yl]amino]methoxy]benzenesulfonic acid Openeye Name: 3-[[[2-(methanesulfonamido)pyrimidin-4-yl]amino]methoxy]benzenesulfonic acid CAS Name: 3-[[[2-(methanesulfonamido)-4-pyrimidinyl]amino]methoxy]benzenesulfonic acid IUPAC Name: 3-[[[2-(methanesulfonamido)pyrimidin-4-yl]amino]methoxy]benzenesulfonic acid Traditional Name: 3-[[[2-(methanesulfonamido)pyrimidin-4-yl]amino]methoxy]besylic acid Formula: C12H14N4O6S2 MolecularWeight: 374.39276

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=NC=CC(=N1)NCOC2=CC(=CC=C2)S(=O)(=O)O

Isomeric SMILES

CS(=O)(=O)NC1=NC=CC(=N1)NCOC2=CC(=CC=C2)S(=O)(=O)O

InChI

InChI=1S/C12H14N4O6S2/c1-23(17,18)16-12-13-6-5-11(15-12)14-8-22-9-3-2-4-10(7-9)24(19,20)21/h2-7H,8H2,1H3,(H,19,20,21)(H2,13,14,15,16)