(2-azanyl-1-cyano-2-methylsulfanyl-ethenyl)-triphenyl-phosphanium iodide

Systemtic Name: (2-azanyl-1-cyano-2-methylsulfanyl-ethenyl)-triphenyl-phosphanium iodide Openeye Name: (2-amino-1-cyano-2-methylsulfanyl-vinyl)-triphenyl-phosphonium iodide CAS Name: [2-amino-1-cyano-2-(methylthio)ethenyl]-triphenylphosphonium iodide IUPAC Name: (2-amino-1-cyano-2-methylsulfanylethenyl)-triphenylphosphanium iodide Traditional Name: [2-amino-1-cyano-2-(methylthio)vinyl]-triphenyl-phosphonium iodide Formula: C22H20IN2PS MolecularWeight: 502.350831

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H20N2PS.HI/c1-26-22(24)21(17-23)25(18-11-5-2-6-12-18,19-13-7-3-8-14-19)20-15-9-4-10-16-20;/h2-16H,24H2,1H3;1H/q+1;/p-1