[2-(4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-yl)-2-phenyl-1-phosphono-ethyl]phosphonic acid

Systemtic Name: [2-(4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-yl)-2-phenyl-1-phosphono-ethyl]phosphonic acid Openeye Name: [2-(4-oxo-2-thioxo-thiazolidin-5-yl)-2-phenyl-1-phosphono-ethyl]phosphonic acid CAS Name: [2-(4-oxo-2-sulfanylidene-5-thiazolidinyl)-2-phenyl-1-phosphonoethyl]phosphonic acid IUPAC Name: [2-(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-yl)-2-phenyl-1-phosphonoethyl]phosphonic acid Traditional Name: [2-(4-keto-2-thioxo-thiazolidin-5-yl)-2-phenyl-1-phosphono-ethyl]phosphonic acid Formula: C11H13NO7P2S2 MolecularWeight: 397.300942

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2C(=O)NC(=S)S2)C(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

C1=CC=C(C=C1)C(C2C(=O)NC(=S)S2)C(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C11H13NO7P2S2/c13-9-8(23-11(22)12-9)7(6-4-2-1-3-5-6)10(20(14,15)16)21(17,18)19/h1-5,7-8,10H,(H,12,13,22)(H2,14,15,16)(H2,17,18,19)