Vitas-M small molecule compound
ethyl 6-amino-4-(4-bromo-2-fluorophenyl)-5-cyano-2-{[(3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl]methyl}-4H-pyran-3-carboxylate
Catalog ID
STK757050
SMILES CCOC(=O)C1=C(CSc2nc(C)cc(c2C#N)C)OC(=C(C1c1ccc(cc1F)Br)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 C24H20BrFN4O3S MW 543.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20BrFN4O3S/c1-4-32-24(31)21-19(11-34-23-16(9-27)12(2)7-13(3)30-23)33-22(29)17(10-28)20(21)15-6-5-14(25)8-18(15)26/h5-8,20H,4,11,29H2,1-3H3InChIKey
AYPNBMBKCUARQA-UHFFFAOYSA-NSynonyms
312265-22-8312265228
CCOC(=O)C1=C(OC(=C(C1C2=C(C=C(C=C2)Br)F)C#N)N)CSC3=C(C(=CC(=N3)C)C)C#N
ETHYL6AMINO4(4BROMO2FLUOROPHENYL)5CYANO2(((3CYANO46DIMETHYL2PYRIDINYL)SULFANYL)METHYL)4HPYRAN3CARBOXYLATE
ethyl6amino4(4bromo2fluorophenyl)5cyano2(((3cyano46dimethylpyridin2yl)sulfanyl)methyl)4Hpyran3carboxylate
ethyl6amino4(4bromo2fluorophenyl)5cyano2(((3cyano46dimethylpyridin2yl)thio)methyl)4Hpyran3carboxylate
ETHYL6AMINO4(4BROMO2FLUOROPHENYL)5CYANO2((3CYANO46DIMETHYLPYRIDIN2YL)SULFANYLMETHYL)4HPYRAN3CARBOXYLATE
InChI=1SC24H20BrFN4O3Sc143224(31)2119(11342316(927)12(2)713(3)3023)3322(29)17(1028)20(21)156514(25)818(15)26h5820H41129H213H3
MFCD01243023
ZINC000000989279
ZINC000000989280
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