N-[[4-iodanyl-2-(trifluoromethyl)phenyl]carbamothioyl]-2-methyl-propanamide

Systemtic Name: N-[[4-iodanyl-2-(trifluoromethyl)phenyl]carbamothioyl]-2-methyl-propanamide Openeye Name: N-[[4-iodo-2-(trifluoromethyl)phenyl]carbamothioyl]-2-methyl-propanamide CAS Name: N-[[4-iodo-2-(trifluoromethyl)anilino]-sulfanylidenemethyl]-2-methylpropanamide IUPAC Name: N-[[4-iodo-2-(trifluoromethyl)phenyl]carbamothioyl]-2-methylpropanamide Traditional Name: N-[[4-iodo-2-(trifluoromethyl)phenyl]thiocarbamoyl]-2-methyl-propionamide Formula: C12H12F3IN2OS MolecularWeight: 416.20116

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC(=S)NC1=C(C=C(C=C1)I)C(F)(F)F

Isomeric SMILES

CC(C)C(=O)NC(=S)NC1=C(C=C(C=C1)I)C(F)(F)F

InChI

InChI=1S/C12H12F3IN2OS/c1-6(2)10(19)18-11(20)17-9-4-3-7(16)5-8(9)12(13,14)15/h3-6H,1-2H3,(H2,17,18,19,20)