[[5-[2-[(6-methylsulfonylpyridin-3-yl)amino]ethoxy]-1-benzothiophen-2-yl]sulfonylamino]methylphosphonic acid

Systemtic Name: [[5-[2-[(6-methylsulfonylpyridin-3-yl)amino]ethoxy]-1-benzothiophen-2-yl]sulfonylamino]methylphosphonic acid Openeye Name: [[5-[2-[(6-methylsulfonyl-3-pyridyl)amino]ethoxy]benzothiophen-2-yl]sulfonylamino]methylphosphonic acid CAS Name: [[5-[2-[(6-methylsulfonyl-3-pyridinyl)amino]ethoxy]-1-benzothiophen-2-yl]sulfonylamino]methylphosphonic acid IUPAC Name: [[5-[2-[(6-methylsulfonylpyridin-3-yl)amino]ethoxy]-1-benzothiophen-2-yl]sulfonylamino]methylphosphonic acid Traditional Name: [[5-[2-[(6-mesyl-3-pyridyl)amino]ethoxy]benzothiophen-2-yl]sulfonylamino]methylphosphonic acid Formula: C17H20N3O8PS3 MolecularWeight: 521.524761

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=NC=C(C=C1)NCCOC2=CC3=C(C=C2)SC(=C3)S(=O)(=O)NCP(=O)(O)O

Isomeric SMILES

CS(=O)(=O)C1=NC=C(C=C1)NCCOC2=CC3=C(C=C2)SC(=C3)S(=O)(=O)NCP(=O)(O)O

InChI

InChI=1S/C17H20N3O8PS3/c1-31(24,25)16-5-2-13(10-19-16)18-6-7-28-14-3-4-15-12(8-14)9-17(30-15)32(26,27)20-11-29(21,22)23/h2-5,8-10,18,20H,6-7,11H2,1H3,(H2,21,22,23)