3-anthracen-2-yl-2-[3,5-bis(3-anthracen-2-ylthiophen-2-yl)phenyl]thiophene

Systemtic Name: 3-anthracen-2-yl-2-[3,5-bis(3-anthracen-2-ylthiophen-2-yl)phenyl]thiophene Openeye Name: 3-(2-anthryl)-2-[3,5-bis[3-(2-anthryl)-2-thienyl]phenyl]thiophene CAS Name: 3-(2-anthracenyl)-2-[3,5-bis[3-(2-anthracenyl)-2-thiophenyl]phenyl]thiophene IUPAC Name: 3-anthracen-2-yl-2-[3,5-bis(3-anthracen-2-ylthiophen-2-yl)phenyl]thiophene Traditional Name: 3-(2-anthryl)-2-[3,5-bis[3-(2-anthryl)-2-thienyl]phenyl]thiophene Formula: C60H36S3 MolecularWeight: 853.12284

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C3C=C(C=CC3=CC2=C1)C4=C(SC=C4)C5=CC(=CC(=C5)C6=C(C=CS6)C7=CC8=CC9=CC=CC=C9C=C8C=C7)C1=C(C=CS1)C1=CC2=CC3=CC=CC=C3C=C2C=C1

Isomeric SMILES

C1=CC=C2C=C3C=C(C=CC3=CC2=C1)C4=C(SC=C4)C5=CC(=CC(=C5)C6=C(C=CS6)C7=CC8=CC9=CC=CC=C9C=C8C=C7)C1=C(C=CS1)C1=CC2=CC3=CC=CC=C3C=C2C=C1

InChI

InChI=1S/C60H36S3/c1-4-10-40-28-49-31-46(16-13-43(49)25-37(40)7-1)55-19-22-61-58(55)52-34-53(59-56(20-23-62-59)47-17-14-44-26-38-8-2-5-11-41(38)29-50(44)32-47)36-54(35-52)60-57(21-24-63-60)48-18-15-45-27-39-9-3-6-12-42(39)30-51(45)33-48/h1-36H