3-(2-phenylethynyl)-1,5-dithiophen-2-yl-pentane-1,5-dione

Systemtic Name: 3-(2-phenylethynyl)-1,5-dithiophen-2-yl-pentane-1,5-dione Openeye Name: 3-(2-phenylethynyl)-1,5-bis(2-thienyl)pentane-1,5-dione CAS Name: 3-(2-phenylethynyl)-1,5-dithiophen-2-ylpentane-1,5-dione IUPAC Name: 3-(2-phenylethynyl)-1,5-dithiophen-2-ylpentane-1,5-dione Traditional Name: 3-(2-phenylethynyl)-1,5-bis(2-thienyl)pentane-1,5-dione Formula: C21H16O2S2 MolecularWeight: 364.48054

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CC(CC(=O)C2=CC=CS2)CC(=O)C3=CC=CS3

Isomeric SMILES

C1=CC=C(C=C1)C#CC(CC(=O)C2=CC=CS2)CC(=O)C3=CC=CS3

InChI

InChI=1S/C21H16O2S2/c22-18(20-8-4-12-24-20)14-17(11-10-16-6-2-1-3-7-16)15-19(23)21-9-5-13-25-21/h1-9,12-13,17H,14-15H2