Vitas-M small molecule compound
ethyl 1-benzyl-4-(3-chloro-5-ethoxy-4-hydroxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STL181478
SMILES CCOC(=O)C1=C(C)N(Cc2ccccc2)C(=O)NC1c1cc(Cl)c(c(c1)OCC)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 C23H25ClN2O5 MW 444.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25ClN2O5/c1-4-30-18-12-16(11-17(24)21(18)27)20-19(22(28)31-5-2)14(3)26(23(29)25-20)13-15-9-7-6-8-10-15/h6-12,20,27H,4-5,13H2,1-3H3,(H,25,29)InChIKey
XAZSVFVEKCQKHB-UHFFFAOYSA-NSynonyms
CCOC1=C(C(=CC(=C1)C2C(=C(N(C(=O)N2)CC3=CC=CC=C3)C)C(=O)OCC)Cl)O
ethyl1benzyl4(3chloro5ethoxy4hydroxyphenyl)6methyl2oxo1234tetrahydropyrimidine5carboxylate
ETHYL3BENZYL6(3CHLORO5ETHOXY4HYDROXYPHENYL)4METHYL2OXO16DIHYDROPYRIMIDINE5CARBOXYLATE
InChI=1SC23H25ClN2O5c1430181216(1117(24)21(18)27)2019(22(28)3152)14(3)26(23(29)2520)131597681015h6122027H4513H213H3(H2529)
MFCD05993346
ZINC000002773971
ZINC000002773972
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