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

Systemtic Name: [2-(4-chlorophenyl)-5-prop-2-enylsulfanyl-1,3-thiazol-4-yl]-triphenyl-phosphanium iodide Openeye Name: [5-allylsulfanyl-2-(4-chlorophenyl)thiazol-4-yl]-triphenyl-phosphonium iodide CAS Name: [2-(4-chlorophenyl)-5-(prop-2-enylthio)-4-thiazolyl]-triphenylphosphonium iodide IUPAC Name: [2-(4-chlorophenyl)-5-prop-2-enylsulfanyl-1,3-thiazol-4-yl]-triphenylphosphanium iodide Traditional Name: [5-(allylthio)-2-(4-chlorophenyl)thiazol-4-yl]-triphenyl-phosphonium iodide Formula: C30H24ClINPS2 MolecularWeight: 655.979491

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=C(N=C(S1)C2=CC=C(C=C2)Cl)[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.[I-]

Isomeric SMILES

C=CCSC1=C(N=C(S1)C2=CC=C(C=C2)Cl)[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.[I-]

InChI

InChI=1S/C30H24ClNPS2.HI/c1-2-22-34-30-28(32-29(35-30)23-18-20-24(31)21-19-23)33(25-12-6-3-7-13-25,26-14-8-4-9-15-26)27-16-10-5-11-17-27;/h2-21H,1,22H2;1H/q+1;/p-1