2-[2,4-bis(chloranyl)phenoxy]-N-[[4-iodanyl-2-(trifluoromethyl)phenyl]carbamothioyl]propanamide

Systemtic Name: 2-[2,4-bis(chloranyl)phenoxy]-N-[[4-iodanyl-2-(trifluoromethyl)phenyl]carbamothioyl]propanamide Openeye Name: 2-(2,4-dichlorophenoxy)-N-[[4-iodo-2-(trifluoromethyl)phenyl]carbamothioyl]propanamide CAS Name: 2-(2,4-dichlorophenoxy)-N-[[4-iodo-2-(trifluoromethyl)anilino]-sulfanylidenemethyl]propanamide IUPAC Name: 2-(2,4-dichlorophenoxy)-N-[[4-iodo-2-(trifluoromethyl)phenyl]carbamothioyl]propanamide Traditional Name: 2-(2,4-dichlorophenoxy)-N-[[4-iodo-2-(trifluoromethyl)phenyl]thiocarbamoyl]propionamide Formula: C17H12Cl2F3IN2O2S MolecularWeight: 563.16006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=S)NC1=C(C=C(C=C1)I)C(F)(F)F)OC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CC(C(=O)NC(=S)NC1=C(C=C(C=C1)I)C(F)(F)F)OC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C17H12Cl2F3IN2O2S/c1-8(27-14-5-2-9(18)6-12(14)19)15(26)25-16(28)24-13-4-3-10(23)7-11(13)17(20,21)22/h2-8H,1H3,(H2,24,25,26,28)