oxidanyl-[1-oxidanyl-3-(4-phenyl-2-phenylazanyl-1,3-thiazol-3-ium-3-yl)-1-phosphono-propyl]phosphinate

Systemtic Name: oxidanyl-[1-oxidanyl-3-(4-phenyl-2-phenylazanyl-1,3-thiazol-3-ium-3-yl)-1-phosphono-propyl]phosphinate Openeye Name: [3-(2-anilino-4-phenyl-thiazol-3-ium-3-yl)-1-hydroxy-1-phosphono-propyl]-hydroxy-phosphinate CAS Name: [3-(2-anilino-4-phenyl-3-thiazol-3-iumyl)-1-hydroxy-1-phosphonopropyl]-hydroxyphosphinate IUPAC Name: [3-(2-anilino-4-phenyl-1,3-thiazol-3-ium-3-yl)-1-hydroxy-1-phosphonopropyl]-hydroxyphosphinate Traditional Name: [3-(2-anilino-4-phenyl-thiazol-3-ium-3-yl)-1-hydroxy-1-phosphono-propyl]-hydroxy-phosphinate Formula: C18H20N2O7P2S MolecularWeight: 470.373122

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC(=[N+]2CCC(O)(P(=O)(O)O)P(=O)(O)[O-])NC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC(=[N+]2CCC(O)(P(=O)(O)O)P(=O)(O)[O-])NC3=CC=CC=C3

InChI

InChI=1S/C18H20N2O7P2S/c21-18(28(22,23)24,29(25,26)27)11-12-20-16(14-7-3-1-4-8-14)13-30-17(20)19-15-9-5-2-6-10-15/h1-10,13,21H,11-12H2,(H4,22,23,24,25,26,27)