Vitas-M small molecule compound
(5E)-1-(3,5-dimethylphenyl)-5-[3-fluoro-4-(morpholin-4-yl)benzylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK206163
SMILES Cc1cc(C)cc(c1)N1C(=O)NC(=O)/C(=C\c2ccc(c(c2)F)N2CCOCC2)/C1=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 C23H22FN3O4 MW 423.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22FN3O4/c1-14-9-15(2)11-17(10-14)27-22(29)18(21(28)25-23(27)30)12-16-3-4-20(19(24)13-16)26-5-7-31-8-6-26/h3-4,9-13H,5-8H2,1-2H3,(H,25,28,30)/b18-12+InChIKey
XHEFHKMTAPAFBL-LDADJPATSA-NSynonyms
(5E)1(35dimethylphenyl)5((3fluoro4morpholin4ylphenyl)methylidene)13diazinane246trione
(5E)1(35DIMETHYLPHENYL)5(3FLUORO4(MORPHOLIN4YL)BENZYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
CC1=CC(=CC(=C1)N2C(=O)C(=CC3=CC(=C(C=C3)N4CCOCC4)F)C(=O)NC2=O)C
Cc1cc(C)cc(c1)N1C(=O)NC(=O)C(=Cc2ccc(c(c2)F)N2CCOCC2)C1=O
InChI=1SC23H22FN3O4c114915(2)1117(1014)2722(29)18(21(28)2523(27)30)12163420(19(24)1316)2657318626h34913H58H212H3(H252830)b1812+
MFCD06666824
ZINC000009971954
ZINC09971954
ZINC9971954
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