(2-methyl-5-methylsulfanyl-1,3-oxazol-4-yl)-triphenyl-phosphanium tetrafluoroborate

Systemtic Name: (2-methyl-5-methylsulfanyl-1,3-oxazol-4-yl)-triphenyl-phosphanium tetrafluoroborate Openeye Name: (2-methyl-5-methylsulfanyl-oxazol-4-yl)-triphenyl-phosphonium tetrafluoroborate CAS Name: [2-methyl-5-(methylthio)-4-oxazolyl]-triphenylphosphonium tetrafluoroborate IUPAC Name: (2-methyl-5-methylsulfanyl-1,3-oxazol-4-yl)-triphenylphosphanium tetrafluoroborate Traditional Name: [2-methyl-5-(methylthio)oxazol-4-yl]-triphenyl-phosphonium tetrafluoroborate Formula: C23H21BF4NOPS MolecularWeight: 477.262314

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CC1=NC(=C(O1)SC)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

[B-](F)(F)(F)F.CC1=NC(=C(O1)SC)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H21NOPS.BF4/c1-18-24-22(23(25-18)27-2)26(19-12-6-3-7-13-19,20-14-8-4-9-15-20)21-16-10-5-11-17-21;2-1(3,4)5/h3-17H,1-2H3;/q+1;-1