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

Systemtic Name: N-[[4-iodanyl-2-(trifluoromethyl)phenyl]carbamothioyl]-3,4-dimethyl-benzamide Openeye Name: N-[[4-iodo-2-(trifluoromethyl)phenyl]carbamothioyl]-3,4-dimethyl-benzamide CAS Name: N-[[4-iodo-2-(trifluoromethyl)anilino]-sulfanylidenemethyl]-3,4-dimethylbenzamide IUPAC Name: N-[[4-iodo-2-(trifluoromethyl)phenyl]carbamothioyl]-3,4-dimethylbenzamide Traditional Name: N-[[4-iodo-2-(trifluoromethyl)phenyl]thiocarbamoyl]-3,4-dimethyl-benzamide Formula: C17H14F3IN2OS MolecularWeight: 478.27054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC(=S)NC2=C(C=C(C=C2)I)C(F)(F)F)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC(=S)NC2=C(C=C(C=C2)I)C(F)(F)F)C

InChI

InChI=1S/C17H14F3IN2OS/c1-9-3-4-11(7-10(9)2)15(24)23-16(25)22-14-6-5-12(21)8-13(14)17(18,19)20/h3-8H,1-2H3,(H2,22,23,24,25)