Vitas-M small molecule compound
dimethyl 1-benzyl-4-(6-bromo-1,3-benzodioxol-5-yl)-1,4-dihydropyridine-3,5-dicarboxylate
Catalog ID
STK404171
SMILES COC(=O)C1=CN(Cc2ccccc2)C=C(C1c1cc2OCOc2cc1Br)C(=O)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 C23H20BrNO6 MW 486.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20BrNO6/c1-28-22(26)16-11-25(10-14-6-4-3-5-7-14)12-17(23(27)29-2)21(16)15-8-19-20(9-18(15)24)31-13-30-19/h3-9,11-12,21H,10,13H2,1-2H3InChIKey
YKBHDDCYPAUZCA-UHFFFAOYSA-NSynonyms
COC(=O)C1=CN(C=C(C1C2=CC3=C(C=C2Br)OCO3)C(=O)OC)CC4=CC=CC=C4
dimethyl1benzyl4(6bromo13benzodioxol5yl)14dihydropyridine35dicarboxylate
DIMETHYL1BENZYL4(6BROMO13BENZODIOXOL5YL)4HPYRIDINE35DICARBOXYLATE
InChI=1SC23H20BrNO6c12822(26)161125(10146435714)1217(23(27)292)21(16)1581920(918(15)24)31133019h39111221H1013H212H3
METHYL4(6BROMO(2HBENZO(D)13DIOXOLAN5YL))5(METHOXYCARBONYL)1BENZYL14DIHYDROPYRIDINE3CARBOXYLATE
MFCD03717175
ZINC000001117891
ZINC01117891
ZINC1117891
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