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

Systemtic Name: [2-(4-chlorophenyl)-5-(phenylmethylsulfanyl)-1,3-thiazol-4-yl]-triphenyl-phosphanium iodide Openeye Name: [5-benzylsulfanyl-2-(4-chlorophenyl)thiazol-4-yl]-triphenyl-phosphonium iodide CAS Name: [2-(4-chlorophenyl)-5-(phenylmethylthio)-4-thiazolyl]-triphenylphosphonium iodide IUPAC Name: [5-benzylsulfanyl-2-(4-chlorophenyl)-1,3-thiazol-4-yl]-triphenylphosphanium iodide Traditional Name: [5-(benzylthio)-2-(4-chlorophenyl)thiazol-4-yl]-triphenyl-phosphonium iodide Formula: C34H26ClINPS2 MolecularWeight: 706.038171

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=C(N=C(S2)C3=CC=C(C=C3)Cl)[P+](C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6.[I-]

Isomeric SMILES

C1=CC=C(C=C1)CSC2=C(N=C(S2)C3=CC=C(C=C3)Cl)[P+](C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6.[I-]

InChI

InChI=1S/C34H26ClNPS2.HI/c35-28-23-21-27(22-24-28)33-36-32(34(39-33)38-25-26-13-5-1-6-14-26)37(29-15-7-2-8-16-29,30-17-9-3-10-18-30)31-19-11-4-12-20-31;/h1-24H,25H2;1H/q+1;/p-1