Vitas-M small molecule compound
ethyl 6-amino-4-(3-bromo-4-fluorophenyl)-2-(chloromethyl)-5-cyano-4H-pyran-3-carboxylate
Catalog ID
STK525932
SMILES CCOC(=O)C1=C(CCl)OC(=C(C1c1ccc(c(c1)Br)F)C#N)N
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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 C16H13BrClFN2O3 MW 415.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13BrClFN2O3/c1-2-23-16(22)14-12(6-18)24-15(21)9(7-20)13(14)8-3-4-11(19)10(17)5-8/h3-5,13H,2,6,21H2,1H3InChIKey
ODOZUINRASSQBA-UHFFFAOYSA-NSynonyms
327986-41-4327986414
CCOC(=O)C1=C(OC(=C(C1C2=CC(=C(C=C2)F)Br)C#N)N)CCl
ethyl6amino4(3bromo4fluorophenyl)2(chloromethyl)5cyano4Hpyran3carboxylate
InChI=1SC16H13BrClFN2O3c122316(22)1412(618)2415(21)9(720)13(14)83411(19)10(17)58h3513H2621H21H3
MFCD00738888
ZINC000002311512
ZINC000002311513
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