1-(4-tert-butylphenyl)sulfanyl-4-naphthalen-2-ylsulfanyl-8-phenylsulfanyl-5-[3-(trifluoromethyl)phenyl]sulfanyl-anthracene-9,10-dione

Systemtic Name: 1-(4-tert-butylphenyl)sulfanyl-4-naphthalen-2-ylsulfanyl-8-phenylsulfanyl-5-[3-(trifluoromethyl)phenyl]sulfanyl-anthracene-9,10-dione Openeye Name: 1-(4-tert-butylphenyl)sulfanyl-4-(2-naphthylsulfanyl)-8-phenylsulfanyl-5-[3-(trifluoromethyl)phenyl]sulfanyl-anthracene-9,10-dione CAS Name: 1-[(4-tert-butylphenyl)thio]-4-(2-naphthalenylthio)-8-(phenylthio)-5-[[3-(trifluoromethyl)phenyl]thio]anthracene-9,10-dione IUPAC Name: 1-(4-tert-butylphenyl)sulfanyl-4-naphthalen-2-ylsulfanyl-8-phenylsulfanyl-5-[3-(trifluoromethyl)phenyl]sulfanylanthracene-9,10-dione Traditional Name: 1-[(4-tert-butylphenyl)thio]-4-(2-naphthylthio)-8-(phenylthio)-5-[[3-(trifluoromethyl)phenyl]thio]-9,10-anthraquinone Formula: C47H33F3O2S4 MolecularWeight: 815.01893

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)SC2=C3C(=C(C=C2)SC4=CC5=CC=CC=C5C=C4)C(=O)C6=C(C=CC(=C6C3=O)SC7=CC=CC=C7)SC8=CC=CC(=C8)C(F)(F)F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)SC2=C3C(=C(C=C2)SC4=CC5=CC=CC=C5C=C4)C(=O)C6=C(C=CC(=C6C3=O)SC7=CC=CC=C7)SC8=CC=CC(=C8)C(F)(F)F

InChI

InChI=1S/C47H33F3O2S4/c1-46(2,3)30-17-20-33(21-18-30)54-37-23-25-39(56-35-19-16-28-10-7-8-11-29(28)26-35)43-41(37)44(51)40-36(53-32-13-5-4-6-14-32)22-24-38(42(40)45(43)52)55-34-15-9-12-31(27-34)47(48,49)50/h4-27H,1-3H3