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

Systemtic Name: 3-butoxy-N-[[2-chloranyl-5-(trifluoromethyl)phenyl]carbamothioyl]benzamide Openeye Name: 3-butoxy-N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]benzamide CAS Name: 3-butoxy-N-[[2-chloro-5-(trifluoromethyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-butoxy-N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]benzamide Traditional Name: 3-butoxy-N-[[2-chloro-5-(trifluoromethyl)phenyl]thiocarbamoyl]benzamide Formula: C19H18ClF3N2O2S MolecularWeight: 430.87163

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18ClF3N2O2S/c1-2-3-9-27-14-6-4-5-12(10-14)17(26)25-18(28)24-16-11-13(19(21,22)23)7-8-15(16)20/h4-8,10-11H,2-3,9H2,1H3,(H2,24,25,26,28)