[(Z)-1-cyano-2-[(E)-dimethylaminomethylideneamino]-2-methylsulfanyl-ethenyl]-triphenyl-phosphanium iodide

Systemtic Name: [(Z)-1-cyano-2-[(E)-dimethylaminomethylideneamino]-2-methylsulfanyl-ethenyl]-triphenyl-phosphanium iodide Openeye Name: [(Z)-1-cyano-2-[(E)-dimethylaminomethyleneamino]-2-methylsulfanyl-vinyl]-triphenyl-phosphonium iodide CAS Name: [(Z)-1-cyano-2-[(E)-dimethylaminomethylideneamino]-2-(methylthio)ethenyl]-triphenylphosphonium iodide IUPAC Name: [(Z)-1-cyano-2-[(E)-dimethylaminomethylideneamino]-2-methylsulfanylethenyl]-triphenylphosphanium iodide Traditional Name: [(Z)-1-cyano-2-[(E)-dimethylaminomethyleneamino]-2-(methylthio)vinyl]-triphenyl-phosphonium iodide Formula: C25H25IN3PS MolecularWeight: 557.429331

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C=NC(=C(C#N)[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)SC.[I-]

Isomeric SMILES

CN(C)/C=N/C(=C(\C#N)/[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)/SC.[I-]

InChI

InChI=1S/C25H25N3PS.HI/c1-28(2)20-27-25(30-3)24(19-26)29(21-13-7-4-8-14-21,22-15-9-5-10-16-22)23-17-11-6-12-18-23;/h4-18,20H,1-3H3;1H/q+1;/p-1/b25-24-,27-20+;