4-[2-(4,5-dihexyl-1,3-dithiol-2-ylidene)-5-(3-oxidanylidenebut-1-ynyl)-1,3-dithiol-4-yl]but-3-yn-2-one

Systemtic Name: 4-[2-(4,5-dihexyl-1,3-dithiol-2-ylidene)-5-(3-oxidanylidenebut-1-ynyl)-1,3-dithiol-4-yl]but-3-yn-2-one Openeye Name: 4-[2-(4,5-dihexyl-1,3-dithiol-2-ylidene)-5-(3-oxobut-1-ynyl)-1,3-dithiol-4-yl]but-3-yn-2-one CAS Name: 4-[2-(4,5-dihexyl-1,3-dithiol-2-ylidene)-5-(3-oxobut-1-ynyl)-1,3-dithiol-4-yl]-3-butyn-2-one IUPAC Name: 4-[2-(4,5-dihexyl-1,3-dithiol-2-ylidene)-5-(3-oxobut-1-ynyl)-1,3-dithiol-4-yl]but-3-yn-2-one Traditional Name: 4-[2-(4,5-dihexyl-1,3-dithiol-2-ylidene)-5-(3-ketobut-1-ynyl)-1,3-dithiol-4-yl]but-3-yn-2-one Formula: C26H32O2S4 MolecularWeight: 504.79108

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(SC(=C2SC(=C(S2)C#CC(=O)C)C#CC(=O)C)S1)CCCCCC

Isomeric SMILES

CCCCCCC1=C(SC(=C2SC(=C(S2)C#CC(=O)C)C#CC(=O)C)S1)CCCCCC

InChI

InChI=1S/C26H32O2S4/c1-5-7-9-11-13-21-22(14-12-10-8-6-2)30-25(29-21)26-31-23(17-15-19(3)27)24(32-26)18-16-20(4)28/h5-14H2,1-4H3