[1-[(4-methylphenyl)carbonylamino]-3-oxidanylidene-3-phenyl-1-sulfanyl-prop-1-en-2-yl]-triphenyl-phosphanium

Systemtic Name: [1-[(4-methylphenyl)carbonylamino]-3-oxidanylidene-3-phenyl-1-sulfanyl-prop-1-en-2-yl]-triphenyl-phosphanium Openeye Name: [1-benzoyl-2-[(4-methylbenzoyl)amino]-2-sulfanyl-vinyl]-triphenyl-phosphonium CAS Name: [1-mercapto-1-[[(4-methylphenyl)-oxomethyl]amino]-3-oxo-3-phenylprop-1-en-2-yl]-triphenylphosphonium IUPAC Name: [1-[(4-methylbenzoyl)amino]-3-oxo-3-phenyl-1-sulfanylprop-1-en-2-yl]-triphenylphosphanium Traditional Name: [1-benzoyl-2-mercapto-2-(p-toluoylamino)vinyl]-triphenyl-phosphonium Formula: C35H29NO2PS+ MolecularWeight: 558.649021

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(=C(C(=O)C2=CC=CC=C2)[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)S

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC(=C(C(=O)C2=CC=CC=C2)[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)S

InChI

InChI=1S/C35H28NO2PS/c1-26-22-24-28(25-23-26)34(38)36-35(40)33(32(37)27-14-6-2-7-15-27)39(29-16-8-3-9-17-29,30-18-10-4-11-19-30)31-20-12-5-13-21-31/h2-25H,1H3,(H-,36,37,38,40)/p+1