[2-(4-methylphenyl)-5-propylsulfanyl-1,3-thiazol-4-yl]-triphenyl-phosphanium

Systemtic Name: [2-(4-methylphenyl)-5-propylsulfanyl-1,3-thiazol-4-yl]-triphenyl-phosphanium Openeye Name: triphenyl-[5-propylsulfanyl-2-(p-tolyl)thiazol-4-yl]phosphonium CAS Name: [2-(4-methylphenyl)-5-(propylthio)-4-thiazolyl]-triphenylphosphonium IUPAC Name: [2-(4-methylphenyl)-5-propylsulfanyl-1,3-thiazol-4-yl]-triphenylphosphanium Traditional Name: triphenyl-[5-(propylthio)-2-(p-tolyl)thiazol-4-yl]phosphonium Formula: C31H29NPS2+ MolecularWeight: 510.672421

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=C(N=C(S1)C2=CC=C(C=C2)C)[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCCSC1=C(N=C(S1)C2=CC=C(C=C2)C)[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H29NPS2/c1-3-23-34-31-29(32-30(35-31)25-21-19-24(2)20-22-25)33(26-13-7-4-8-14-26,27-15-9-5-10-16-27)28-17-11-6-12-18-28/h4-22H,3,23H2,1-2H3/q+1