Vitas-M small molecule compound
(5E)-5-{[(1,3-benzodioxol-5-ylmethyl)amino]methylidene}-6-hydroxy-3-(2-methoxyphenyl)pyrimidine-2,4(3H,5H)-dione
Catalog ID
STL044802
SMILES COc1ccccc1N1C(=O)N=C(/C(=C\NCc2ccc3c(c2)OCO3)/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 C20H17N3O6 MW 395.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17N3O6/c1-27-15-5-3-2-4-14(15)23-19(25)13(18(24)22-20(23)26)10-21-9-12-6-7-16-17(8-12)29-11-28-16/h2-8,10,21H,9,11H2,1H3,(H,22,24,26)/b13-10+InChIKey
SYLWCCOTPNCJBV-JLHYYAGUSA-NSynonyms
(5E)5(((13benzodioxol5ylmethyl)amino)methylidene)6hydroxy3(2methoxyphenyl)pyrimidine24(3H5H)dione
(5E)5((13BENZODIOXOL5YLMETHYLAMINO)METHYLIDENE)1(2METHOXYPHENYL)13DIAZINANE246TRIONE
COC1=CC=CC=C1N2C(=O)C(=CNCC3=CC4=C(C=C3)OCO4)C(=O)NC2=O
COc1ccccc1N1C(=O)N=C(C(=CNCc2ccc3c(c2)OCO3)C1=O)O
InChI=1SC20H17N3O6c12715532414(15)2319(25)13(18(24)2220(23)26)1021912671617(812)29112816h281021H911H21H3(H222426)b1310+
MFCD04082623
ZINC000006096945
ZINC06096945
ZINC6096945
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