4,5-bis(butylsulfanyl)-3,6-bis(fluoranyl)benzene-1,2-dicarbonitrile

Systemtic Name: 4,5-bis(butylsulfanyl)-3,6-bis(fluoranyl)benzene-1,2-dicarbonitrile Openeye Name: 4,5-bis(butylsulfanyl)-3,6-difluoro-phthalonitrile CAS Name: 4,5-bis(butylthio)-3,6-difluorobenzene-1,2-dicarbonitrile IUPAC Name: 4,5-bis(butylsulfanyl)-3,6-difluorobenzene-1,2-dicarbonitrile Traditional Name: 4,5-bis(butylthio)-3,6-difluoro-phthalonitrile Formula: C16H18F2N2S2 MolecularWeight: 340.454326

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=C(C(=C(C(=C1SCCCC)F)C#N)C#N)F

Isomeric SMILES

CCCCSC1=C(C(=C(C(=C1SCCCC)F)C#N)C#N)F

InChI

InChI=1S/C16H18F2N2S2/c1-3-5-7-21-15-13(17)11(9-19)12(10-20)14(18)16(15)22-8-6-4-2/h3-8H2,1-2H3