2,4-dimethyl-5-[2-(4-methyl-3-octyl-thiophen-2-yl)ethynyl]-3-octyl-thiophene

Systemtic Name: 2,4-dimethyl-5-[2-(4-methyl-3-octyl-thiophen-2-yl)ethynyl]-3-octyl-thiophene Openeye Name: 2,4-dimethyl-5-[2-(4-methyl-3-octyl-2-thienyl)ethynyl]-3-octyl-thiophene CAS Name: 2,4-dimethyl-5-[2-(4-methyl-3-octyl-2-thiophenyl)ethynyl]-3-octylthiophene IUPAC Name: 2,4-dimethyl-5-[2-(4-methyl-3-octylthiophen-2-yl)ethynyl]-3-octylthiophene Traditional Name: 2,4-dimethyl-5-[2-(4-methyl-3-octyl-2-thienyl)ethynyl]-3-octyl-thiophene Formula: C29H44S2 MolecularWeight: 456.78966

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(SC=C1C)C#CC2=C(C(=C(S2)C)CCCCCCCC)C

Isomeric SMILES

CCCCCCCCC1=C(SC=C1C)C#CC2=C(C(=C(S2)C)CCCCCCCC)C

InChI

InChI=1S/C29H44S2/c1-6-8-10-12-14-16-18-26-23(3)22-30-29(26)21-20-28-24(4)27(25(5)31-28)19-17-15-13-11-9-7-2/h22H,6-19H2,1-5H3