Vitas-M small molecule compound
(5E)-1-(2-fluorophenyl)-5-{1-[(3,4,5-trimethoxybenzyl)amino]ethylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STL447366
SMILES COc1c(OC)cc(cc1OC)CN/C(=C/1\C(=O)NC(=O)N(C1=O)c1ccccc1F)/C
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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 C22H22FN3O6 MW 443.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22FN3O6/c1-12(24-11-13-9-16(30-2)19(32-4)17(10-13)31-3)18-20(27)25-22(29)26(21(18)28)15-8-6-5-7-14(15)23/h5-10,24H,11H2,1-4H3,(H,25,27,29)/b18-12+InChIKey
YJXJVQINMYFZGP-LDADJPATSA-NSynonyms
(5E)1(2fluorophenyl)5(1((345trimethoxybenzyl)amino)ethylidene)pyrimidine246(1H3H5H)trione
(5E)1(2fluorophenyl)5(1((345trimethoxyphenyl)methylamino)ethylidene)13diazinane246trione
CC(=C1C(=O)NC(=O)N(C1=O)C2=CC=CC=C2F)NCC3=CC(=C(C(=C3)OC)OC)OC
COc1c(OC)cc(cc1OC)CNC(=C1C(=O)NC(=O)N(C1=O)c1ccccc1F)C
InChI=1SC22H22FN3O6c112(241113916(302)19(324)17(1013)313)1820(27)2522(29)26(21(18)28)15865714(15)23h51024H11H214H3(H252729)b1812+
MFCD06243656
ZINC000025179025
ZINC25179025
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