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

Systemtic Name: 5-bromanyl-2-butoxy-N-[[3-(trifluoromethyl)phenyl]carbamothioyl]benzamide Openeye Name: 5-bromo-2-butoxy-N-[[3-(trifluoromethyl)phenyl]carbamothioyl]benzamide CAS Name: 5-bromo-2-butoxy-N-[sulfanylidene-[3-(trifluoromethyl)anilino]methyl]benzamide IUPAC Name: 5-bromo-2-butoxy-N-[[3-(trifluoromethyl)phenyl]carbamothioyl]benzamide Traditional Name: 5-bromo-2-butoxy-N-[[3-(trifluoromethyl)phenyl]thiocarbamoyl]benzamide Formula: C19H18BrF3N2O2S MolecularWeight: 475.32263

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C19H18BrF3N2O2S/c1-2-3-9-27-16-8-7-13(20)11-15(16)17(26)25-18(28)24-14-6-4-5-12(10-14)19(21,22)23/h4-8,10-11H,2-3,9H2,1H3,(H2,24,25,26,28)