N-(2-iodanylphenyl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(2-iodanylphenyl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanamide Openeye Name: N-(2-iodophenyl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-acetamide CAS Name: N-(2-iodophenyl)-2-[[4-(trifluoromethyl)-2-pyrimidinyl]thio]acetamide IUPAC Name: N-(2-iodophenyl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylacetamide Traditional Name: N-(2-iodophenyl)-2-[[4-(trifluoromethyl)pyrimidin-2-yl]thio]acetamide Formula: C13H9F3IN3OS MolecularWeight: 439.19474

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)CSC2=NC=CC(=N2)C(F)(F)F)I

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)CSC2=NC=CC(=N2)C(F)(F)F)I

InChI

InChI=1S/C13H9F3IN3OS/c14-13(15,16)10-5-6-18-12(20-10)22-7-11(21)19-9-4-2-1-3-8(9)17/h1-6H,7H2,(H,19,21)