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

Systemtic Name: N-[[4-iodanyl-2-(trifluoromethyl)phenyl]carbamothioyl]-4-propoxy-benzamide Openeye Name: N-[[4-iodo-2-(trifluoromethyl)phenyl]carbamothioyl]-4-propoxy-benzamide CAS Name: N-[[4-iodo-2-(trifluoromethyl)anilino]-sulfanylidenemethyl]-4-propoxybenzamide IUPAC Name: N-[[4-iodo-2-(trifluoromethyl)phenyl]carbamothioyl]-4-propoxybenzamide Traditional Name: N-[[4-iodo-2-(trifluoromethyl)phenyl]thiocarbamoyl]-4-propoxy-benzamide Formula: C18H16F3IN2O2S MolecularWeight: 508.29652

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=C(C=C(C=C2)I)C(F)(F)F

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=C(C=C(C=C2)I)C(F)(F)F

InChI

InChI=1S/C18H16F3IN2O2S/c1-2-9-26-13-6-3-11(4-7-13)16(25)24-17(27)23-15-8-5-12(22)10-14(15)18(19,20)21/h3-8,10H,2,9H2,1H3,(H2,23,24,25,27)