Vitas-M small molecule compound
1-ethoxy-1-oxopropan-2-yl 4-(1,3-benzodioxol-5-yl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK363764
SMILES CCOC(=O)C(OC(=O)C1=C(C)NC(=O)NC1c1ccc2c(c1)OCO2)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 C18H20N2O7 MW 376.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N2O7/c1-4-24-16(21)10(3)27-17(22)14-9(2)19-18(23)20-15(14)11-5-6-12-13(7-11)26-8-25-12/h5-7,10,15H,4,8H2,1-3H3,(H2,19,20,23)InChIKey
NRKUEHDGHMUQEY-UHFFFAOYSA-NSynonyms
(1ETHOXY1OXOPROPAN2YL)4(13BENZODIOXOL5YL)6METHYL2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
1ethoxy1oxopropan2yl4(13benzodioxol5yl)6methyl2oxo1234tetrahydropyrimidine5carboxylate
CCOC(=O)C(C)OC(=O)C1=C(NC(=O)NC1C2=CC3=C(C=C2)OCO3)C
ETHYL2(6(2HBENZO(34D)13DIOXOLAN5YL)4METHYL2OXO136TRIHYDROPYRIMIDIN5YLCARBONYLOXY)PROPANOATE
InChI=1SC18H20N2O7c142416(21)10(3)2717(22)149(2)1918(23)2015(14)11561213(711)2682512h571015H48H213H3(H2192023)
MFCD01656017
ZINC000004211238
ZINC000004211246
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