[2-[4-(1-benzothiophen-3-ylsulfonylamino)phenyl]-2-oxidanylidene-ethyl]sulfanylphosphonic acid

Systemtic Name: [2-[4-(1-benzothiophen-3-ylsulfonylamino)phenyl]-2-oxidanylidene-ethyl]sulfanylphosphonic acid Openeye Name: [2-[4-(benzothiophen-3-ylsulfonylamino)phenyl]-2-oxo-ethyl]sulfanylphosphonic acid CAS Name: [[2-[4-(1-benzothiophen-3-ylsulfonylamino)phenyl]-2-oxoethyl]thio]phosphonic acid IUPAC Name: [2-[4-(1-benzothiophen-3-ylsulfonylamino)phenyl]-2-oxoethyl]sulfanylphosphonic acid Traditional Name: [[2-[4-(benzothiophen-3-ylsulfonylamino)phenyl]-2-keto-ethyl]thio]phosphonic acid Formula: C16H14NO6PS3 MolecularWeight: 443.454221

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CS2)S(=O)(=O)NC3=CC=C(C=C3)C(=O)CSP(=O)(O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CS2)S(=O)(=O)NC3=CC=C(C=C3)C(=O)CSP(=O)(O)O

InChI

InChI=1S/C16H14NO6PS3/c18-14(9-26-24(19,20)21)11-5-7-12(8-6-11)17-27(22,23)16-10-25-15-4-2-1-3-13(15)16/h1-8,10,17H,9H2,(H2,19,20,21)