3,4-bis(fluoranyl)-5-(4-methoxyphenyl)sulfanyl-6-phenoxy-benzene-1,2-dicarbonitrile

Systemtic Name: 3,4-bis(fluoranyl)-5-(4-methoxyphenyl)sulfanyl-6-phenoxy-benzene-1,2-dicarbonitrile Openeye Name: 3,4-difluoro-5-(4-methoxyphenyl)sulfanyl-6-phenoxy-phthalonitrile CAS Name: 3,4-difluoro-5-[(4-methoxyphenyl)thio]-6-phenoxybenzene-1,2-dicarbonitrile IUPAC Name: 3,4-difluoro-5-(4-methoxyphenyl)sulfanyl-6-phenoxybenzene-1,2-dicarbonitrile Traditional Name: 3,4-difluoro-5-[(4-methoxyphenyl)thio]-6-phenoxy-phthalonitrile Formula: C21H12F2N2O2S MolecularWeight: 394.393986

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)SC2=C(C(=C(C(=C2F)F)C#N)C#N)OC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)SC2=C(C(=C(C(=C2F)F)C#N)C#N)OC3=CC=CC=C3

InChI

InChI=1S/C21H12F2N2O2S/c1-26-13-7-9-15(10-8-13)28-21-19(23)18(22)16(11-24)17(12-25)20(21)27-14-5-3-2-4-6-14/h2-10H,1H3