2-[4-[4-(9,10-diphenylanthracen-2-yl)phenyl]sulfanylphenyl]-9,10-diphenyl-anthracene

Systemtic Name: 2-[4-[4-(9,10-diphenylanthracen-2-yl)phenyl]sulfanylphenyl]-9,10-diphenyl-anthracene Openeye Name: 2-[4-[4-(9,10-diphenyl-2-anthryl)phenyl]sulfanylphenyl]-9,10-diphenyl-anthracene CAS Name: 2-[4-[[4-(9,10-diphenyl-2-anthracenyl)phenyl]thio]phenyl]-9,10-diphenylanthracene IUPAC Name: 2-[4-[4-(9,10-diphenylanthracen-2-yl)phenyl]sulfanylphenyl]-9,10-diphenylanthracene Traditional Name: 2-[4-[[4-(9,10-diphenyl-2-anthryl)phenyl]thio]phenyl]-9,10-diphenyl-anthracene Formula: C64H42S MolecularWeight: 843.08328

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C=CC(=CC3=C(C4=CC=CC=C42)C5=CC=CC=C5)C6=CC=C(C=C6)SC7=CC=C(C=C7)C8=CC9=C(C1=CC=CC=C1C(=C9C=C8)C1=CC=CC=C1)C1=CC=CC=C1

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C=CC(=CC3=C(C4=CC=CC=C42)C5=CC=CC=C5)C6=CC=C(C=C6)SC7=CC=C(C=C7)C8=CC9=C(C1=CC=CC=C1C(=C9C=C8)C1=CC=CC=C1)C1=CC=CC=C1

InChI

InChI=1S/C64H42S/c1-5-17-45(18-6-1)61-53-25-13-15-27-55(53)63(47-21-9-3-10-22-47)59-41-49(33-39-57(59)61)43-29-35-51(36-30-43)65-52-37-31-44(32-38-52)50-34-40-58-60(42-50)64(48-23-11-4-12-24-48)56-28-16-14-26-54(56)62(58)46-19-7-2-8-20-46/h1-42H