Vitas-M small molecule compound
benzyl 4-(3-ethoxy-4-hydroxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK094456
SMILES CCOc1cc(ccc1O)C1NC(=O)NC(=C1C(=O)OCc1ccccc1)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 C21H22N2O5 MW 382.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O5/c1-3-27-17-11-15(9-10-16(17)24)19-18(13(2)22-21(26)23-19)20(25)28-12-14-7-5-4-6-8-14/h4-11,19,24H,3,12H2,1-2H3,(H2,22,23,26)InChIKey
RAWRYWNNWGWJLH-UHFFFAOYSA-NSynonyms
297157-82-5297157825
benzyl4(3ethoxy4hydroxyphenyl)6methyl2oxo1234tetrahydropyrimidine5carboxylate
benzyl4(3ethoxy4hydroxyphenyl)6methyl2oxo34dihydro1Hpyrimidine5carboxylate
CCOC1=C(C=CC(=C1)C2C(=C(NC(=O)N2)C)C(=O)OCC3=CC=CC=C3)O
CCOc1cc(ccc1O)C1NC(=O)NC(=C1C(=O)OCc1ccccc1)C
InChI=1SC21H22N2O5c1327171115(91016(17)24)1918(13(2)2221(26)2319)20(25)2812147546814h4111924H312H212H3(H2222326)
MFCD01193171
STK094456
ZINC000000812897
ZINC000000812899
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