N-(3-fluorophenyl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(3-fluorophenyl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanamide Openeye Name: N-(3-fluorophenyl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-acetamide CAS Name: N-(3-fluorophenyl)-2-[[4-(trifluoromethyl)-2-pyrimidinyl]thio]acetamide IUPAC Name: N-(3-fluorophenyl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylacetamide Traditional Name: N-(3-fluorophenyl)-2-[[4-(trifluoromethyl)pyrimidin-2-yl]thio]acetamide Formula: C13H9F4N3OS MolecularWeight: 331.288673

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H9F4N3OS/c14-8-2-1-3-9(6-8)19-11(21)7-22-12-18-5-4-10(20-12)13(15,16)17/h1-6H,7H2,(H,19,21)