N-[1-(2-bromanyl-5-cyano-phenoxy)-2-cyano-propan-2-yl]-4-(trifluoromethylsulfanyl)benzamide

Systemtic Name: N-[1-(2-bromanyl-5-cyano-phenoxy)-2-cyano-propan-2-yl]-4-(trifluoromethylsulfanyl)benzamide Openeye Name: N-[2-(2-bromo-5-cyano-phenoxy)-1-cyano-1-methyl-ethyl]-4-(trifluoromethylsulfanyl)benzamide CAS Name: N-[1-(2-bromo-5-cyanophenoxy)-2-cyanopropan-2-yl]-4-(trifluoromethylthio)benzamide IUPAC Name: N-[1-(2-bromo-5-cyanophenoxy)-2-cyanopropan-2-yl]-4-(trifluoromethylsulfanyl)benzamide Traditional Name: N-[2-(2-bromo-5-cyano-phenoxy)-1-cyano-1-methyl-ethyl]-4-(trifluoromethylthio)benzamide Formula: C19H13BrF3N3O2S MolecularWeight: 484.28963

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC1=C(C=CC(=C1)C#N)Br)(C#N)NC(=O)C2=CC=C(C=C2)SC(F)(F)F

Isomeric SMILES

CC(COC1=C(C=CC(=C1)C#N)Br)(C#N)NC(=O)C2=CC=C(C=C2)SC(F)(F)F

InChI

InChI=1S/C19H13BrF3N3O2S/c1-18(10-25,11-28-16-8-12(9-24)2-7-15(16)20)26-17(27)13-3-5-14(6-4-13)29-19(21,22)23/h2-8H,11H2,1H3,(H,26,27)