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

Systemtic Name: N-[[4-iodanyl-2-(trifluoromethyl)phenyl]carbamothioyl]propanamide Openeye Name: N-[[4-iodo-2-(trifluoromethyl)phenyl]carbamothioyl]propanamide CAS Name: N-[[4-iodo-2-(trifluoromethyl)anilino]-sulfanylidenemethyl]propanamide IUPAC Name: N-[[4-iodo-2-(trifluoromethyl)phenyl]carbamothioyl]propanamide Traditional Name: N-[[4-iodo-2-(trifluoromethyl)phenyl]thiocarbamoyl]propionamide Formula: C11H10F3IN2OS MolecularWeight: 402.17458

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H10F3IN2OS/c1-2-9(18)17-10(19)16-8-4-3-6(15)5-7(8)11(12,13)14/h3-5H,2H2,1H3,(H2,16,17,18,19)