(5-methylsulfanyl-2-phenyl-1,3-oxazol-4-yl)-triphenyl-phosphanium iodide

Systemtic Name: (5-methylsulfanyl-2-phenyl-1,3-oxazol-4-yl)-triphenyl-phosphanium iodide Openeye Name: (5-methylsulfanyl-2-phenyl-oxazol-4-yl)-triphenyl-phosphonium iodide CAS Name: [5-(methylthio)-2-phenyl-4-oxazolyl]-triphenylphosphonium iodide IUPAC Name: (5-methylsulfanyl-2-phenyl-1,3-oxazol-4-yl)-triphenylphosphanium iodide Traditional Name: [5-(methylthio)-2-phenyl-oxazol-4-yl]-triphenyl-phosphonium iodide Formula: C28H23INOPS MolecularWeight: 579.431551

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(N=C(O1)C2=CC=CC=C2)[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.[I-]

Isomeric SMILES

CSC1=C(N=C(O1)C2=CC=CC=C2)[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.[I-]

InChI

InChI=1S/C28H23NOPS.HI/c1-32-28-27(29-26(30-28)22-14-6-2-7-15-22)31(23-16-8-3-9-17-23,24-18-10-4-11-19-24)25-20-12-5-13-21-25;/h2-21H,1H3;1H/q+1;/p-1