[(E)-1-[(4-methylphenyl)carbonylamino]-2-pyridin-2-ylsulfanyl-ethenyl]-triphenyl-phosphanium

Systemtic Name: [(E)-1-[(4-methylphenyl)carbonylamino]-2-pyridin-2-ylsulfanyl-ethenyl]-triphenyl-phosphanium Openeye Name: [(E)-1-[(4-methylbenzoyl)amino]-2-(2-pyridylsulfanyl)vinyl]-triphenyl-phosphonium CAS Name: [(E)-1-[[(4-methylphenyl)-oxomethyl]amino]-2-(2-pyridinylthio)ethenyl]-triphenylphosphonium IUPAC Name: [(E)-1-[(4-methylbenzoyl)amino]-2-pyridin-2-ylsulfanylethenyl]-triphenylphosphanium Traditional Name: triphenyl-[(E)-1-(p-toluoylamino)-2-(2-pyridylthio)vinyl]phosphonium Formula: C33H28N2OPS+ MolecularWeight: 531.626981

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(=CSC2=CC=CC=N2)[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N/C(=C\SC2=CC=CC=N2)/[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C33H27N2OPS/c1-26-20-22-27(23-21-26)33(36)35-31(25-38-32-19-11-12-24-34-32)37(28-13-5-2-6-14-28,29-15-7-3-8-16-29)30-17-9-4-10-18-30/h2-25H,1H3/p+1/b31-25+