2-[bis(methylsulfanyl)methylidene]-4,4-dibutyl-7-fluoranyl-naphthalene-1,3-dione

Systemtic Name: 2-[bis(methylsulfanyl)methylidene]-4,4-dibutyl-7-fluoranyl-naphthalene-1,3-dione Openeye Name: 2-[bis(methylsulfanyl)methylene]-4,4-dibutyl-7-fluoro-tetralin-1,3-dione CAS Name: 2-[bis(methylthio)methylidene]-4,4-dibutyl-7-fluoronaphthalene-1,3-dione IUPAC Name: 2-[bis(methylsulfanyl)methylidene]-4,4-dibutyl-7-fluoronaphthalene-1,3-dione Traditional Name: 2-[bis(methylthio)methylene]-4,4-dibutyl-7-fluoro-tetralin-1,3-quinone Formula: C21H27FO2S2 MolecularWeight: 394.566283

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(C2=C(C=C(C=C2)F)C(=O)C(=C(SC)SC)C1=O)CCCC

Isomeric SMILES

CCCCC1(C2=C(C=C(C=C2)F)C(=O)C(=C(SC)SC)C1=O)CCCC

InChI

InChI=1S/C21H27FO2S2/c1-5-7-11-21(12-8-6-2)16-10-9-14(22)13-15(16)18(23)17(19(21)24)20(25-3)26-4/h9-10,13H,5-8,11-12H2,1-4H3