4-(3,4-dibutylphenyl)sulfanyl-3,6-bis(fluoranyl)benzene-1,2-dicarbonitrile

Systemtic Name: 4-(3,4-dibutylphenyl)sulfanyl-3,6-bis(fluoranyl)benzene-1,2-dicarbonitrile Openeye Name: 4-(3,4-dibutylphenyl)sulfanyl-3,6-difluoro-phthalonitrile CAS Name: 4-[(3,4-dibutylphenyl)thio]-3,6-difluorobenzene-1,2-dicarbonitrile IUPAC Name: 4-(3,4-dibutylphenyl)sulfanyl-3,6-difluorobenzene-1,2-dicarbonitrile Traditional Name: 4-[(3,4-dibutylphenyl)thio]-3,6-difluoro-phthalonitrile Formula: C22H22F2N2S MolecularWeight: 384.485286

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=C(C=C1)SC2=C(C(=C(C(=C2)F)C#N)C#N)F)CCCC

Isomeric SMILES

CCCCC1=C(C=C(C=C1)SC2=C(C(=C(C(=C2)F)C#N)C#N)F)CCCC

InChI

InChI=1S/C22H22F2N2S/c1-3-5-7-15-9-10-17(11-16(15)8-6-4-2)27-21-12-20(23)18(13-25)19(14-26)22(21)24/h9-12H,3-8H2,1-2H3