2-hexadecyl-1,4-dithiophen-2-yl-butane-1,4-dione

Systemtic Name: 2-hexadecyl-1,4-dithiophen-2-yl-butane-1,4-dione Openeye Name: 2-hexadecyl-1,4-bis(2-thienyl)butane-1,4-dione CAS Name: 2-hexadecyl-1,4-dithiophen-2-ylbutane-1,4-dione IUPAC Name: 2-hexadecyl-1,4-dithiophen-2-ylbutane-1,4-dione Traditional Name: 2-cetyl-1,4-bis(2-thienyl)butane-1,4-dione Formula: C28H42O2S2 MolecularWeight: 474.76188

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(CC(=O)C1=CC=CS1)C(=O)C2=CC=CS2

Isomeric SMILES

CCCCCCCCCCCCCCCCC(CC(=O)C1=CC=CS1)C(=O)C2=CC=CS2

InChI

InChI=1S/C28H42O2S2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-24(28(30)27-20-17-22-32-27)23-25(29)26-19-16-21-31-26/h16-17,19-22,24H,2-15,18,23H2,1H3