Vitas-M small molecule compound
(5E)-1-(2,4-dimethylphenyl)-5-{1-[(2-methoxybenzyl)amino]ethylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STL447317
SMILES COc1ccccc1CN/C(=C/1\C(=O)NC(=O)N(C1=O)c1ccc(cc1C)C)/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 C22H23N3O4 MW 393.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N3O4/c1-13-9-10-17(14(2)11-13)25-21(27)19(20(26)24-22(25)28)15(3)23-12-16-7-5-6-8-18(16)29-4/h5-11,23H,12H2,1-4H3,(H,24,26,28)/b19-15+InChIKey
LLBMXFLEKSNLNJ-XDJHFCHBSA-NSynonyms
(5E)1(24dimethylphenyl)5(1((2methoxybenzyl)amino)ethylidene)pyrimidine246(1H3H5H)trione
(5E)1(24dimethylphenyl)5(1((2methoxyphenyl)methylamino)ethylidene)13diazinane246trione
CC1=CC(=C(C=C1)N2C(=O)C(=C(C)NCC3=CC=CC=C3OC)C(=O)NC2=O)C
COc1ccccc1CNC(=C1C(=O)NC(=O)N(C1=O)c1ccc(cc1C)C)C
InChI=1SC22H23N3O4c11391017(14(2)1113)2521(27)19(20(26)2422(25)28)15(3)231216756818(16)294h51123H12H214H3(H242628)b1915+
MFCD06243634
ZINC000005800587
ZINC5800587
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