Vitas-M small molecule compound
ethyl ({3-cyano-4-[4-(difluoromethoxy)phenyl]-6-oxo-1,4,5,6-tetrahydropyridin-2-yl}sulfanyl)acetate
Catalog ID
STK764056
SMILES CCOC(=O)CSC1=C(C#N)C(CC(=O)N1)c1ccc(cc1)OC(F)F
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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 C17H16F2N2O4S MW 382.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16F2N2O4S/c1-2-24-15(23)9-26-16-13(8-20)12(7-14(22)21-16)10-3-5-11(6-4-10)25-17(18)19/h3-6,12,17H,2,7,9H2,1H3,(H,21,22)InChIKey
NOFBBFRNGCMREE-UHFFFAOYSA-NSynonyms
327082-85-9327082859
CCOC(=O)CSC1=C(C(CC(=O)N1)C2=CC=C(C=C2)OC(F)F)C#N
ethyl((3cyano4(4(difluoromethoxy)phenyl)6oxo1456tetrahydropyridin2yl)sulfanyl)acetate
ethyl2((3cyano4(4(difluoromethoxy)phenyl)6oxo1456tetrahydropyridin2yl)thio)acetate
ETHYL2((5CYANO4(4(DIFLUOROMETHOXY)PHENYL)2OXO34DIHYDRO1HPYRIDIN6YL)SULFANYL)ACETATE
InChI=1SC17H16F2N2O4Sc122415(23)9261613(820)12(714(22)2116)103511(6410)2517(18)19h361217H279H21H3(H2122)
MFCD02232540
ZINC000000874531
ZINC000000874533
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