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

Systemtic Name: 4-(4-tert-butylphenyl)sulfanyl-1-naphthalen-2-ylsulfanyl-5-[3-(trifluoromethyl)phenyl]sulfanyl-anthracene-9,10-dione Openeye Name: 4-(4-tert-butylphenyl)sulfanyl-1-(2-naphthylsulfanyl)-5-[3-(trifluoromethyl)phenyl]sulfanyl-anthracene-9,10-dione CAS Name: 4-[(4-tert-butylphenyl)thio]-1-(2-naphthalenylthio)-5-[[3-(trifluoromethyl)phenyl]thio]anthracene-9,10-dione IUPAC Name: 4-(4-tert-butylphenyl)sulfanyl-1-naphthalen-2-ylsulfanyl-5-[3-(trifluoromethyl)phenyl]sulfanylanthracene-9,10-dione Traditional Name: 4-[(4-tert-butylphenyl)thio]-1-(2-naphthylthio)-5-[[3-(trifluoromethyl)phenyl]thio]-9,10-anthraquinone Formula: C41H29F3O2S3 MolecularWeight: 706.85797

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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(C3=O)C(=CC=C6)SC7=CC=CC(=C7)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(C3=O)C(=CC=C6)SC7=CC=CC(=C7)C(F)(F)F

InChI

InChI=1S/C41H29F3O2S3/c1-40(2,3)26-15-18-28(19-16-26)47-34-21-20-33(49-30-17-14-24-8-4-5-9-25(24)22-30)36-37(34)39(46)35-31(38(36)45)12-7-13-32(35)48-29-11-6-10-27(23-29)41(42,43)44/h4-23H,1-3H3