[2-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]sulfanyl-1-[(4-methylphenyl)carbonylamino]ethenyl]-triphenyl-phosphanium

Systemtic Name: [2-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]sulfanyl-1-[(4-methylphenyl)carbonylamino]ethenyl]-triphenyl-phosphanium Openeye Name: [2-[2-(4-bromophenyl)-2-oxo-ethyl]sulfanyl-1-[(4-methylbenzoyl)amino]vinyl]-triphenyl-phosphonium CAS Name: [2-[[2-(4-bromophenyl)-2-oxoethyl]thio]-1-[[(4-methylphenyl)-oxomethyl]amino]ethenyl]-triphenylphosphonium IUPAC Name: [2-[2-(4-bromophenyl)-2-oxoethyl]sulfanyl-1-[(4-methylbenzoyl)amino]ethenyl]-triphenylphosphanium Traditional Name: [2-[[2-(4-bromophenyl)-2-keto-ethyl]thio]-1-(p-toluoylamino)vinyl]-triphenyl-phosphonium Formula: C36H30BrNO2PS+ MolecularWeight: 651.571661

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C36H29BrNO2PS/c1-27-17-19-29(20-18-27)36(40)38-35(26-42-25-34(39)28-21-23-30(37)24-22-28)41(31-11-5-2-6-12-31,32-13-7-3-8-14-32)33-15-9-4-10-16-33/h2-24,26H,25H2,1H3/p+1