2-[[(2E)-3-oxidanylidene-2-[3-oxidanylidene-5-(2-phosphonosulfanylethylsulfamoyl)-1H-indol-2-ylidene]-1H-indol-5-yl]sulfonylamino]ethylsulfanylphosphonic acid

Systemtic Name: 2-[[(2E)-3-oxidanylidene-2-[3-oxidanylidene-5-(2-phosphonosulfanylethylsulfamoyl)-1H-indol-2-ylidene]-1H-indol-5-yl]sulfonylamino]ethylsulfanylphosphonic acid Openeye Name: 2-[[(2E)-3-oxo-2-[3-oxo-5-(2-phosphonosulfanylethylsulfamoyl)indolin-2-ylidene]indolin-5-yl]sulfonylamino]ethylsulfanylphosphonic acid CAS Name: [2-[[(2E)-3-oxo-2-[3-oxo-5-[2-(phosphonothio)ethylsulfamoyl]-1H-indol-2-ylidene]-1H-indol-5-yl]sulfonylamino]ethylthio]phosphonic acid IUPAC Name: 2-[[(2E)-3-oxo-2-[3-oxo-5-(2-phosphonosulfanylethylsulfamoyl)-1H-indol-2-ylidene]-1H-indol-5-yl]sulfonylamino]ethylsulfanylphosphonic acid Traditional Name: [2-[[(2E)-3-keto-2-[3-keto-5-[2-(phosphonothio)ethylsulfamoyl]indolin-2-ylidene]indolin-5-yl]sulfonylamino]ethylthio]phosphonic acid Formula: C20H22N4O12P2S4 MolecularWeight: 700.615802

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1S(=O)(=O)NCCSP(=O)(O)O)C(=O)C(=C3C(=O)C4=C(N3)C=CC(=C4)S(=O)(=O)NCCSP(=O)(O)O)N2

Isomeric SMILES

C1=CC2=C(C=C1S(=O)(=O)NCCSP(=O)(O)O)C(=O)/C(=C\3/C(=O)C4=C(N3)C=CC(=C4)S(=O)(=O)NCCSP(=O)(O)O)/N2

InChI

InChI=1S/C20H22N4O12P2S4/c25-19-13-9-11(41(33,34)21-5-7-39-37(27,28)29)1-3-15(13)23-17(19)18-20(26)14-10-12(2-4-16(14)24-18)42(35,36)22-6-8-40-38(30,31)32/h1-4,9-10,21-24H,5-8H2,(H2,27,28,29)(H2,30,31,32)/b18-17+