4-tert-butyl-N-[[4-iodanyl-2-(trifluoromethyl)phenyl]carbamothioyl]benzamide

Systemtic Name: 4-tert-butyl-N-[[4-iodanyl-2-(trifluoromethyl)phenyl]carbamothioyl]benzamide Openeye Name: 4-tert-butyl-N-[[4-iodo-2-(trifluoromethyl)phenyl]carbamothioyl]benzamide CAS Name: 4-tert-butyl-N-[[4-iodo-2-(trifluoromethyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-tert-butyl-N-[[4-iodo-2-(trifluoromethyl)phenyl]carbamothioyl]benzamide Traditional Name: 4-tert-butyl-N-[[4-iodo-2-(trifluoromethyl)phenyl]thiocarbamoyl]benzamide Formula: C19H18F3IN2OS MolecularWeight: 506.3237

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18F3IN2OS/c1-18(2,3)12-6-4-11(5-7-12)16(26)25-17(27)24-15-9-8-13(23)10-14(15)19(20,21)22/h4-10H,1-3H3,(H2,24,25,26,27)