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

Systemtic Name: 3-(2,6-dimethylphenoxy)-6-fluoranyl-4,5-bis(phenylsulfanyl)benzene-1,2-dicarbonitrile Openeye Name: 3-(2,6-dimethylphenoxy)-6-fluoro-4,5-bis(phenylsulfanyl)phthalonitrile CAS Name: 3-(2,6-dimethylphenoxy)-6-fluoro-4,5-bis(phenylthio)benzene-1,2-dicarbonitrile IUPAC Name: 3-(2,6-dimethylphenoxy)-6-fluoro-4,5-bis(phenylsulfanyl)benzene-1,2-dicarbonitrile Traditional Name: 3-(2,6-dimethylphenoxy)-6-fluoro-4,5-bis(phenylthio)phthalonitrile Formula: C28H19FN2OS2 MolecularWeight: 482.591663

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OC2=C(C(=C(C(=C2C#N)C#N)F)SC3=CC=CC=C3)SC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=CC=C1)C)OC2=C(C(=C(C(=C2C#N)C#N)F)SC3=CC=CC=C3)SC4=CC=CC=C4

InChI

InChI=1S/C28H19FN2OS2/c1-18-10-9-11-19(2)25(18)32-26-23(17-31)22(16-30)24(29)27(33-20-12-5-3-6-13-20)28(26)34-21-14-7-4-8-15-21/h3-15H,1-2H3