Vitas-M small molecule compound
(2E)-3-{3-[(2-chloro-5-fluoropyrimidin-4-yl)oxy]-4-methoxyphenyl}-2-cyano-N-(2-methoxyphenyl)prop-2-enamide
Catalog ID
STK285227
SMILES N#C/C(=C\c1ccc(c(c1)Oc1nc(Cl)ncc1F)OC)/C(=O)Nc1ccccc1OC
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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 C22H16ClFN4O4 MW 454.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16ClFN4O4/c1-30-17-6-4-3-5-16(17)27-20(29)14(11-25)9-13-7-8-18(31-2)19(10-13)32-21-15(24)12-26-22(23)28-21/h3-10,12H,1-2H3,(H,27,29)/b14-9+InChIKey
XFUCSJVVBBEQHG-NTEUORMPSA-NSynonyms
(2E)3(3((2CHLORO5FLUOROPYRIMIDIN4YL)OXY)4METHOXYPHENYL)2CYANON(2METHOXYPHENYL)PROP2ENAMIDE
(E)3(3(2CHLORO5FLUOROPYRIMIDIN4YL)OXY4METHOXYPHENYL)2CYANON(2METHOXYPHENYL)PROP2ENAMIDE
COC1=C(C=C(C=C1)C=C(C#N)C(=O)NC2=CC=CC=C2OC)OC3=NC(=NC=C3F)Cl
InChI=1SC22H16ClFN4O4c13017643516(17)2720(29)14(1125)9137818(312)19(1013)322115(24)122622(23)2821h31012H12H3(H2729)b149+
MFCD03763239
N#CC(=Cc1ccc(c(c1)Oc1nc(Cl)ncc1F)OC)C(=O)Nc1ccccc1OC
ZINC000009234495
ZINC09234495
ZINC9234495
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