3-[4-(2-cyano-2-diphenylphosphinothioyl-ethyl)phenyl]-2-diphenylphosphinothioyl-propanenitrile

Systemtic Name: 3-[4-(2-cyano-2-diphenylphosphinothioyl-ethyl)phenyl]-2-diphenylphosphinothioyl-propanenitrile Openeye Name: 3-[4-(2-cyano-2-diphenylphosphinothioyl-ethyl)phenyl]-2-diphenylphosphinothioyl-propanenitrile CAS Name: 3-[4-(2-cyano-2-diphenylphosphinothioylethyl)phenyl]-2-diphenylphosphinothioylpropanenitrile IUPAC Name: 3-[4-(2-cyano-2-diphenylphosphinothioylethyl)phenyl]-2-diphenylphosphinothioylpropanenitrile Traditional Name: 3-[4-(2-cyano-2-diphenylthiophosphoryl-ethyl)phenyl]-2-diphenylthiophosphoryl-propionitrile Formula: C36H30N2P2S2 MolecularWeight: 616.714322

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)P(=S)(C2=CC=CC=C2)C(CC3=CC=C(C=C3)CC(C#N)P(=S)(C4=CC=CC=C4)C5=CC=CC=C5)C#N

Isomeric SMILES

C1=CC=C(C=C1)P(=S)(C2=CC=CC=C2)C(CC3=CC=C(C=C3)CC(C#N)P(=S)(C4=CC=CC=C4)C5=CC=CC=C5)C#N

InChI

InChI=1S/C36H30N2P2S2/c37-27-35(39(41,31-13-5-1-6-14-31)32-15-7-2-8-16-32)25-29-21-23-30(24-22-29)26-36(28-38)40(42,33-17-9-3-10-18-33)34-19-11-4-12-20-34/h1-24,35-36H,25-26H2