(1Z)-2,4-bis(chloranyl)-N-[(Z)-2-cyano-1-sulfanyl-2-triphenylphosphaniumyl-ethenyl]benzenecarboximidate

Systemtic Name: (1Z)-2,4-bis(chloranyl)-N-[(Z)-2-cyano-1-sulfanyl-2-triphenylphosphaniumyl-ethenyl]benzenecarboximidate Openeye Name: (1Z)-2,4-dichloro-N-[(Z)-2-cyano-1-sulfanyl-2-triphenylphosphaniumyl-vinyl]benzenecarboximidate CAS Name: (1Z)-2,4-dichloro-N-[(Z)-2-cyano-1-mercapto-2-triphenylphosphiniumylethenyl]benzenecarboximidate IUPAC Name: (1Z)-2,4-dichloro-N-[(Z)-2-cyano-1-sulfanyl-2-triphenylphosphaniumylethenyl]benzenecarboximidate Traditional Name: (1Z)-2,4-dichloro-N-[(Z)-2-cyano-1-mercapto-2-triphenylphosphiniumyl-vinyl]benzenecarboximidate Formula: C28H19Cl2N2OPS MolecularWeight: 533.408021

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C(=C(N=C(C4=C(C=C(C=C4)Cl)Cl)[O-])S)C#N

Isomeric SMILES

C1=CC=C(C=C1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)/C(=C(/N=C(/C4=C(C=C(C=C4)Cl)Cl)\[O-])\S)/C#N

InChI

InChI=1S/C28H19Cl2N2OPS/c29-20-16-17-24(25(30)18-20)27(33)32-28(35)26(19-31)34(21-10-4-1-5-11-21,22-12-6-2-7-13-22)23-14-8-3-9-15-23/h1-18H,(H-,32,33,35)/b28-26-