(5-ethylsulfanyl-2-phenyl-1,3-thiazol-4-yl)-triphenyl-phosphanium iodide

Systemtic Name: (5-ethylsulfanyl-2-phenyl-1,3-thiazol-4-yl)-triphenyl-phosphanium iodide Openeye Name: (5-ethylsulfanyl-2-phenyl-thiazol-4-yl)-triphenyl-phosphonium iodide CAS Name: [5-(ethylthio)-2-phenyl-4-thiazolyl]-triphenylphosphonium iodide IUPAC Name: (5-ethylsulfanyl-2-phenyl-1,3-thiazol-4-yl)-triphenylphosphanium iodide Traditional Name: [5-(ethylthio)-2-phenyl-thiazol-4-yl]-triphenyl-phosphonium iodide Formula: C29H25INPS2 MolecularWeight: 609.523731

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H25NPS2.HI/c1-2-32-29-27(30-28(33-29)23-15-7-3-8-16-23)31(24-17-9-4-10-18-24,25-19-11-5-12-20-25)26-21-13-6-14-22-26;/h3-22H,2H2,1H3;1H/q+1;/p-1