Vitas-M small molecule compound
(5E)-1-(4-fluorobenzyl)-5-({[2-(morpholin-4-ium-4-yl)ethyl]amino}methylidene)-2,6-dioxo-1,2,5,6-tetrahydropyrimidin-4-olate
Catalog ID
STL041087
SMILES Fc1ccc(cc1)CN1C(=O)N=C(/C(=C\NCC[NH+]2CCOCC2)/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 C18H21FN4O4 MW 376.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21FN4O4/c19-14-3-1-13(2-4-14)12-23-17(25)15(16(24)21-18(23)26)11-20-5-6-22-7-9-27-10-8-22/h1-4,11,20H,5-10,12H2,(H,21,24,26)/b15-11+InChIKey
XEZCKLOUAASXMC-RVDMUPIBSA-NSynonyms
(5E)1((4FLUOROPHENYL)METHYL)5((2MORPHOLIN4YLETHYLAMINO)METHYLIDENE)13DIAZINANE246TRIONE
(5E)1(4fluorobenzyl)5(((2(morpholin4ium4yl)ethyl)amino)methylidene)26dioxo1256tetrahydropyrimidin4olate
C1COCCN1CCNC=C2C(=O)NC(=O)N(C2=O)CC3=CC=C(C=C3)F
Fc1ccc(cc1)CN1C(=O)N=C(C(=CNCC(NH+)2CCOCC2)C1=O)(O)
InChI=1SC18H21FN4O4c19143113(2414)122317(25)15(16(24)2118(23)26)11205622792710822h141120H51012H2(H212426)b1511+
MFCD18248074
ZINC000020332966
ZINC20332966
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