2,9-bis(3,4-dibutylthiophen-2-yl)-1,10-phenanthroline

Systemtic Name: 2,9-bis(3,4-dibutylthiophen-2-yl)-1,10-phenanthroline Openeye Name: 2,9-bis(3,4-dibutyl-2-thienyl)-1,10-phenanthroline CAS Name: 2,9-bis(3,4-dibutyl-2-thiophenyl)-1,10-phenanthroline IUPAC Name: 2,9-bis(3,4-dibutylthiophen-2-yl)-1,10-phenanthroline Traditional Name: 2,9-bis(3,4-dibutyl-2-thienyl)-1,10-phenanthroline Formula: C36H44N2S2 MolecularWeight: 568.87796

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CSC(=C1CCCC)C2=NC3=C(C=CC4=C3N=C(C=C4)C5=C(C(=CS5)CCCC)CCCC)C=C2

Isomeric SMILES

CCCCC1=CSC(=C1CCCC)C2=NC3=C(C=CC4=C3N=C(C=C4)C5=C(C(=CS5)CCCC)CCCC)C=C2

InChI

InChI=1S/C36H44N2S2/c1-5-9-13-27-23-39-35(29(27)15-11-7-3)31-21-19-25-17-18-26-20-22-32(38-34(26)33(25)37-31)36-30(16-12-8-4)28(24-40-36)14-10-6-2/h17-24H,5-16H2,1-4H3