Vitas-M small molecule compound
(5Z)-1-(4-fluorophenyl)-5-[2-methoxy-4-(morpholin-4-yl)benzylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STL372386
SMILES COc1cc(ccc1/C=C\1/C(=O)NC(=O)N(C1=O)c1ccc(cc1)F)N1CCOCC1
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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 C22H20FN3O5 MW 425.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20FN3O5/c1-30-19-13-17(25-8-10-31-11-9-25)5-2-14(19)12-18-20(27)24-22(29)26(21(18)28)16-6-3-15(23)4-7-16/h2-7,12-13H,8-11H2,1H3,(H,24,27,29)/b18-12-InChIKey
WRLKPZVTSQTBHV-PDGQHHTCSA-NSynonyms
(5Z)1(4fluorophenyl)5((2methoxy4morpholin4ylphenyl)methylidene)13diazinane246trione
(5Z)1(4fluorophenyl)5(2methoxy4(morpholin4yl)benzylidene)pyrimidine246(1H3H5H)trione
COC1=C(C=CC(=C1)N2CCOCC2)C=C3C(=O)NC(=O)N(C3=O)C4=CC=C(C=C4)F
COc1cc(ccc1C=C1C(=O)NC(=O)N(C1=O)c1ccc(cc1)F)N1CCOCC1
InChI=1SC22H20FN3O5c130191317(258103111925)5214(19)121820(27)2422(29)26(21(18)28)166315(23)4716h271213H811H21H3(H242729)b1812
MFCD28950937
ZINC000033314266
ZINC33314266
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