[2-(4-cyanophenyl)phenyl] 2-pentylthieno[2,3-b]thiophene-5-carboxylate

Systemtic Name: [2-(4-cyanophenyl)phenyl] 2-pentylthieno[2,3-b]thiophene-5-carboxylate Openeye Name: [2-(4-cyanophenyl)phenyl] 2-pentylthieno[2,3-b]thiophene-5-carboxylate CAS Name: 2-pentyl-5-thieno[2,3-b]thiophenecarboxylic acid [2-(4-cyanophenyl)phenyl] ester IUPAC Name: [2-(4-cyanophenyl)phenyl] 2-pentylthieno[2,3-b]thiophene-5-carboxylate Traditional Name: 2-amylthieno[2,3-b]thiophene-5-carboxylic acid [2-(4-cyanophenyl)phenyl] ester Formula: C25H21NO2S2 MolecularWeight: 431.56974

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC2=C(S1)SC(=C2)C(=O)OC3=CC=CC=C3C4=CC=C(C=C4)C#N

Isomeric SMILES

CCCCCC1=CC2=C(S1)SC(=C2)C(=O)OC3=CC=CC=C3C4=CC=C(C=C4)C#N

InChI

InChI=1S/C25H21NO2S2/c1-2-3-4-7-20-14-19-15-23(30-25(19)29-20)24(27)28-22-9-6-5-8-21(22)18-12-10-17(16-26)11-13-18/h5-6,8-15H,2-4,7H2,1H3