1-[2-(4,5-dipentyl-1,3-dithiol-2-ylidene)-5-methyl-1,3-dithiol-4-yl]-2-phenyl-ethanone

Systemtic Name: 1-[2-(4,5-dipentyl-1,3-dithiol-2-ylidene)-5-methyl-1,3-dithiol-4-yl]-2-phenyl-ethanone Openeye Name: 1-[2-(4,5-dipentyl-1,3-dithiol-2-ylidene)-5-methyl-1,3-dithiol-4-yl]-2-phenyl-ethanone CAS Name: 1-[2-(4,5-dipentyl-1,3-dithiol-2-ylidene)-5-methyl-1,3-dithiol-4-yl]-2-phenylethanone IUPAC Name: 1-[2-(4,5-dipentyl-1,3-dithiol-2-ylidene)-5-methyl-1,3-dithiol-4-yl]-2-phenylethanone Traditional Name: 1-[2-(4,5-diamyl-1,3-dithiol-2-ylidene)-5-methyl-1,3-dithiol-4-yl]-2-phenyl-ethanone Formula: C25H32OS4 MolecularWeight: 476.78098

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(SC(=C2SC(=C(S2)C(=O)CC3=CC=CC=C3)C)S1)CCCCC

Isomeric SMILES

CCCCCC1=C(SC(=C2SC(=C(S2)C(=O)CC3=CC=CC=C3)C)S1)CCCCC

InChI

InChI=1S/C25H32OS4/c1-4-6-9-15-21-22(16-10-7-5-2)29-25(28-21)24-27-18(3)23(30-24)20(26)17-19-13-11-8-12-14-19/h8,11-14H,4-7,9-10,15-17H2,1-3H3