1,4-bis(fluoranyl)-2,3-bis[(4-methylphenyl)sulfanyl]anthracene-9,10-dione

Systemtic Name: 1,4-bis(fluoranyl)-2,3-bis[(4-methylphenyl)sulfanyl]anthracene-9,10-dione Openeye Name: 1,4-difluoro-2,3-bis(p-tolylsulfanyl)anthracene-9,10-dione CAS Name: 1,4-difluoro-2,3-bis[(4-methylphenyl)thio]anthracene-9,10-dione IUPAC Name: 1,4-difluoro-2,3-bis[(4-methylphenyl)sulfanyl]anthracene-9,10-dione Traditional Name: 1,4-difluoro-2,3-bis(p-tolylthio)-9,10-anthraquinone Formula: C28H18F2O2S2 MolecularWeight: 488.568126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(C3=C(C(=C2SC4=CC=C(C=C4)C)F)C(=O)C5=CC=CC=C5C3=O)F

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(C3=C(C(=C2SC4=CC=C(C=C4)C)F)C(=O)C5=CC=CC=C5C3=O)F

InChI

InChI=1S/C28H18F2O2S2/c1-15-7-11-17(12-8-15)33-27-23(29)21-22(26(32)20-6-4-3-5-19(20)25(21)31)24(30)28(27)34-18-13-9-16(2)10-14-18/h3-14H,1-2H3