1-(3-bromanyl-4-methoxy-phenyl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanone

Systemtic Name: 1-(3-bromanyl-4-methoxy-phenyl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanone Openeye Name: 1-(3-bromo-4-methoxy-phenyl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanone CAS Name: 1-(3-bromo-4-methoxyphenyl)-2-[[4-(trifluoromethyl)-2-pyrimidinyl]thio]ethanone IUPAC Name: 1-(3-bromo-4-methoxyphenyl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylethanone Traditional Name: 1-(3-bromo-4-methoxy-phenyl)-2-[[4-(trifluoromethyl)pyrimidin-2-yl]thio]ethanone Formula: C14H10BrF3N2O2S MolecularWeight: 407.20561

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)CSC2=NC=CC(=N2)C(F)(F)F)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)CSC2=NC=CC(=N2)C(F)(F)F)Br

InChI

InChI=1S/C14H10BrF3N2O2S/c1-22-11-3-2-8(6-9(11)15)10(21)7-23-13-19-5-4-12(20-13)14(16,17)18/h2-6H,7H2,1H3