Vitas-M small molecule compound
2-phenylethyl 4-(3-bromo-2,5-dimethoxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK373484
SMILES COc1c(Br)cc(cc1C1NC(=O)NC(=C1C(=O)OCCc1ccccc1)C)OC
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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 C22H23BrN2O5 MW 475.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23BrN2O5/c1-13-18(21(26)30-10-9-14-7-5-4-6-8-14)19(25-22(27)24-13)16-11-15(28-2)12-17(23)20(16)29-3/h4-8,11-12,19H,9-10H2,1-3H3,(H2,24,25,27)InChIKey
QLIMQLORTCABHO-UHFFFAOYSA-NSynonyms
2phenylethyl4(3bromo25dimethoxyphenyl)6methyl2oxo1234tetrahydropyrimidine5carboxylate
2phenylethyl4(3bromo25dimethoxyphenyl)6methyl2oxo34dihydro1Hpyrimidine5carboxylate
CC1=C(C(NC(=O)N1)C2=CC(=CC(=C2OC)Br)OC)C(=O)OCCC3=CC=CC=C3
InChI=1SC22H23BrN2O5c11318(21(26)30109147546814)19(2522(27)2413)161115(282)1217(23)20(16)293h48111219H910H213H3(H2242527)
MFCD00718213
PHENETHYL4(3BROMO25DIMETHOXYPHENYL)6METHYL2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
ZINC000004100905
ZINC000004100908
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