[2-(4-methylphenyl)-5-prop-2-enylsulfanyl-1,3-oxazol-4-yl]-triphenyl-phosphanium iodide

Systemtic Name: [2-(4-methylphenyl)-5-prop-2-enylsulfanyl-1,3-oxazol-4-yl]-triphenyl-phosphanium iodide Openeye Name: [5-allylsulfanyl-2-(p-tolyl)oxazol-4-yl]-triphenyl-phosphonium iodide CAS Name: [2-(4-methylphenyl)-5-(prop-2-enylthio)-4-oxazolyl]-triphenylphosphonium iodide IUPAC Name: [2-(4-methylphenyl)-5-prop-2-enylsulfanyl-1,3-oxazol-4-yl]-triphenylphosphanium iodide Traditional Name: [5-(allylthio)-2-(p-tolyl)oxazol-4-yl]-triphenyl-phosphonium iodide Formula: C31H27INOPS MolecularWeight: 619.495411

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=C(O2)SCC=C)[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.[I-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=C(O2)SCC=C)[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.[I-]

InChI

InChI=1S/C31H27NOPS.HI/c1-3-23-35-31-30(32-29(33-31)25-21-19-24(2)20-22-25)34(26-13-7-4-8-14-26,27-15-9-5-10-16-27)28-17-11-6-12-18-28;/h3-22H,1,23H2,2H3;1H/q+1;/p-1