2-bromanyl-3-octyl-5-(4-octyl-5-thiophen-2-yl-thiophen-2-yl)thiophene

Systemtic Name: 2-bromanyl-3-octyl-5-(4-octyl-5-thiophen-2-yl-thiophen-2-yl)thiophene Openeye Name: 2-bromo-3-octyl-5-[4-octyl-5-(2-thienyl)-2-thienyl]thiophene CAS Name: 2-bromo-3-octyl-5-(4-octyl-5-thiophen-2-yl-2-thiophenyl)thiophene IUPAC Name: 2-bromo-3-octyl-5-(4-octyl-5-thiophen-2-ylthiophen-2-yl)thiophene Traditional Name: 2-bromo-3-octyl-5-[4-octyl-5-(2-thienyl)-2-thienyl]thiophene Formula: C28H39BrS3 MolecularWeight: 551.70826

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(SC(=C1)C2=CC(=C(S2)Br)CCCCCCCC)C3=CC=CS3

Isomeric SMILES

CCCCCCCCC1=C(SC(=C1)C2=CC(=C(S2)Br)CCCCCCCC)C3=CC=CS3

InChI

InChI=1S/C28H39BrS3/c1-3-5-7-9-11-13-16-22-20-25(31-27(22)24-18-15-19-30-24)26-21-23(28(29)32-26)17-14-12-10-8-6-4-2/h15,18-21H,3-14,16-17H2,1-2H3