3-butoxy-N-[[4-iodanyl-2-(trifluoromethyl)phenyl]carbamothioyl]benzamide

Systemtic Name: 3-butoxy-N-[[4-iodanyl-2-(trifluoromethyl)phenyl]carbamothioyl]benzamide Openeye Name: 3-butoxy-N-[[4-iodo-2-(trifluoromethyl)phenyl]carbamothioyl]benzamide CAS Name: 3-butoxy-N-[[4-iodo-2-(trifluoromethyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-butoxy-N-[[4-iodo-2-(trifluoromethyl)phenyl]carbamothioyl]benzamide Traditional Name: 3-butoxy-N-[[4-iodo-2-(trifluoromethyl)phenyl]thiocarbamoyl]benzamide Formula: C19H18F3IN2O2S MolecularWeight: 522.3231

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18F3IN2O2S/c1-2-3-9-27-14-6-4-5-12(10-14)17(26)25-18(28)24-16-8-7-13(23)11-15(16)19(20,21)22/h4-8,10-11H,2-3,9H2,1H3,(H2,24,25,26,28)