1,3,4,5-tetraphenyl-2,2-bis[3-(phenylmethylsulfanyl)-2-phenylsulfanyl-phenyl]silole

Systemtic Name: 1,3,4,5-tetraphenyl-2,2-bis[3-(phenylmethylsulfanyl)-2-phenylsulfanyl-phenyl]silole Openeye Name: 2,2-bis(3-benzylsulfanyl-2-phenylsulfanyl-phenyl)-1,3,4,5-tetraphenyl-silole CAS Name: 1,3,4,5-tetraphenyl-2,2-bis[3-(phenylmethylthio)-2-(phenylthio)phenyl]silole IUPAC Name: 2,2-bis(3-benzylsulfanyl-2-phenylsulfanylphenyl)-1,3,4,5-tetraphenylsilole Traditional Name: 2,2-bis[3-(benzylthio)-2-(phenylthio)phenyl]-1,3,4,5-tetraphenyl-silole Formula: C66H50S4Si MolecularWeight: 999.4487

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=CC=CC(=C2SC3=CC=CC=C3)C4(C(=C(C(=[Si]4C5=CC=CC=C5)C6=CC=CC=C6)C7=CC=CC=C7)C8=CC=CC=C8)C9=C(C(=CC=C9)SCC1=CC=CC=C1)SC1=CC=CC=C1

Isomeric SMILES

C1=CC=C(C=C1)CSC2=CC=CC(=C2SC3=CC=CC=C3)C4(C(=C(C(=[Si]4C5=CC=CC=C5)C6=CC=CC=C6)C7=CC=CC=C7)C8=CC=CC=C8)C9=C(C(=CC=C9)SCC1=CC=CC=C1)SC1=CC=CC=C1

InChI

InChI=1S/C66H50S4Si/c1-9-27-49(28-10-1)47-67-59-45-25-43-57(63(59)69-54-37-19-6-20-38-54)66(58-44-26-46-60(68-48-50-29-11-2-12-30-50)64(58)70-55-39-21-7-22-40-55)62(52-33-15-4-16-34-52)61(51-31-13-3-14-32-51)65(53-35-17-5-18-36-53)71(66)56-41-23-8-24-42-56/h1-46H,47-48H2