N-[5-(4-bromanylphenoxy)-2-(trifluoromethyl)phenyl]-2-pyrimidin-2-ylsulfanyl-ethanamide

Systemtic Name: N-[5-(4-bromanylphenoxy)-2-(trifluoromethyl)phenyl]-2-pyrimidin-2-ylsulfanyl-ethanamide Openeye Name: N-[5-(4-bromophenoxy)-2-(trifluoromethyl)phenyl]-2-pyrimidin-2-ylsulfanyl-acetamide CAS Name: N-[5-(4-bromophenoxy)-2-(trifluoromethyl)phenyl]-2-(2-pyrimidinylthio)acetamide IUPAC Name: N-[5-(4-bromophenoxy)-2-(trifluoromethyl)phenyl]-2-pyrimidin-2-ylsulfanylacetamide Traditional Name: N-[5-(4-bromophenoxy)-2-(trifluoromethyl)phenyl]-2-(2-pyrimidylthio)acetamide Formula: C19H13BrF3N3O2S MolecularWeight: 484.28963

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)SCC(=O)NC2=C(C=CC(=C2)OC3=CC=C(C=C3)Br)C(F)(F)F

Isomeric SMILES

C1=CN=C(N=C1)SCC(=O)NC2=C(C=CC(=C2)OC3=CC=C(C=C3)Br)C(F)(F)F

InChI

InChI=1S/C19H13BrF3N3O2S/c20-12-2-4-13(5-3-12)28-14-6-7-15(19(21,22)23)16(10-14)26-17(27)11-29-18-24-8-1-9-25-18/h1-10H,11H2,(H,26,27)