Vitas-M small molecule compound
(5E)-3-[2-(3,4-dimethoxyphenyl)ethyl]-5-{[(3-fluorophenyl)amino]methylidene}-6-hydroxypyrimidine-2,4(3H,5H)-dione
Catalog ID
STL051957
SMILES COc1ccc(cc1OC)CCN1C(=O)N=C(/C(=C\Nc2cccc(c2)F)/C1=O)O
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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 C21H20FN3O5 MW 413.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20FN3O5/c1-29-17-7-6-13(10-18(17)30-2)8-9-25-20(27)16(19(26)24-21(25)28)12-23-15-5-3-4-14(22)11-15/h3-7,10-12,23H,8-9H2,1-2H3,(H,24,26,28)/b16-12+InChIKey
BSGLLMVMGIXAJN-FOWTUZBSSA-NSynonyms
(5E)1(2(34DIMETHOXYPHENYL)ETHYL)5((3FLUOROANILINO)METHYLIDENE)13DIAZINANE246TRIONE
(5E)3(2(34dimethoxyphenyl)ethyl)5(((3fluorophenyl)amino)methylidene)6hydroxypyrimidine24(3H5H)dione
1(2(34DIMETHOXYPHENYL)ETHYL)5(1(3FLUOROPHENYLAMINO)METH(E)YLIDENE)PYRIMIDINE246TRIONE
COC1=C(C=C(C=C1)CCN2C(=O)C(=CNC3=CC(=CC=C3)F)C(=O)NC2=O)OC
COc1ccc(cc1OC)CCN1C(=O)N=C(C(=CNc2cccc(c2)F)C1=O)O
InChI=1SC21H20FN3O5c129177613(1018(17)302)892520(27)16(19(26)2421(25)28)12231553414(22)1115h37101223H89H212H3(H242628)b1612+
MFCD05732890
ZINC000009357843
ZINC09357843
ZINC9357843
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