Vitas-M small molecule compound
ethyl {[6-(4-bromophenyl)-3-cyano-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}acetate
Catalog ID
STK815234
SMILES CCOC(=O)CSc1nc(cc(c1C#N)C(F)(F)F)c1ccc(cc1)Br
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C17H12BrF3N2O2S MW 445.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12BrF3N2O2S/c1-2-25-15(24)9-26-16-12(8-22)13(17(19,20)21)7-14(23-16)10-3-5-11(18)6-4-10/h3-7H,2,9H2,1H3InChIKey
QXVQUTAOHCJBPQ-UHFFFAOYSA-NSynonyms
CCOC(=O)CSC1=C(C(=CC(=N1)C2=CC=C(C=C2)Br)C(F)(F)F)C#N
ethyl((6(4bromophenyl)3cyano4(trifluoromethyl)pyridin2yl)sulfanyl)acetate
ETHYL2(6(4BROMOPHENYL)3CYANO4(TRIFLUOROMETHYL)PYRIDIN2YL)SULFANYLACETATE
InChI=1SC17H12BrF3N2O2Sc122515(24)9261612(822)13(17(1920)21)714(2316)103511(18)6410h37H29H21H3
MFCD04442581
ZINC000016805582
ZINC16805582
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