(4-ethylsulfanyl-2-phenyl-1H-imidazol-5-yl)-triphenyl-phosphanium iodide

Systemtic Name: (4-ethylsulfanyl-2-phenyl-1H-imidazol-5-yl)-triphenyl-phosphanium iodide Openeye Name: (4-ethylsulfanyl-2-phenyl-1H-imidazol-5-yl)-triphenyl-phosphonium iodide CAS Name: [4-(ethylthio)-2-phenyl-1H-imidazol-5-yl]-triphenylphosphonium iodide IUPAC Name: (4-ethylsulfanyl-2-phenyl-1H-imidazol-5-yl)-triphenylphosphanium iodide Traditional Name: [4-(ethylthio)-2-phenyl-1H-imidazol-5-yl]-triphenyl-phosphonium iodide Formula: C29H26IN2PS MolecularWeight: 592.473371

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(NC(=N1)C2=CC=CC=C2)[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.[I-]

Isomeric SMILES

CCSC1=C(NC(=N1)C2=CC=CC=C2)[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.[I-]

InChI

InChI=1S/C29H26N2PS.HI/c1-2-33-29-28(30-27(31-29)23-15-7-3-8-16-23)32(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,(H,30,31);1H/q+1;/p-1