5-bromanyl-2-(3-methylbutoxy)-N-[[3-(trifluoromethyl)phenyl]carbamothioyl]benzamide

Systemtic Name: 5-bromanyl-2-(3-methylbutoxy)-N-[[3-(trifluoromethyl)phenyl]carbamothioyl]benzamide Openeye Name: 5-bromo-2-isopentyloxy-N-[[3-(trifluoromethyl)phenyl]carbamothioyl]benzamide CAS Name: 5-bromo-2-(3-methylbutoxy)-N-[sulfanylidene-[3-(trifluoromethyl)anilino]methyl]benzamide IUPAC Name: 5-bromo-2-(3-methylbutoxy)-N-[[3-(trifluoromethyl)phenyl]carbamothioyl]benzamide Traditional Name: 5-bromo-2-isoamoxy-N-[[3-(trifluoromethyl)phenyl]thiocarbamoyl]benzamide Formula: C20H20BrF3N2O2S MolecularWeight: 489.34921

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C20H20BrF3N2O2S/c1-12(2)8-9-28-17-7-6-14(21)11-16(17)18(27)26-19(29)25-15-5-3-4-13(10-15)20(22,23)24/h3-7,10-12H,8-9H2,1-2H3,(H2,25,26,27,29)