Vitas-M small molecule compound

dimethyl 4-(6-bromo-1,3-benzodioxol-5-yl)-1-(4-chlorobenzyl)-1,4-dihydropyridine-3,5-dicarboxylate

Catalog ID
STK404116
SMILES COC(=O)C1=CN(Cc2ccc(cc2)Cl)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 C23H19BrClNO6 MW 520.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19BrClNO6/c1-29-22(27)16-10-26(9-13-3-5-14(25)6-4-13)11-17(23(28)30-2)21(16)15-7-19-20(8-18(15)24)32-12-31-19/h3-8,10-11,21H,9,12H2,1-2H3
InChIKey
DNDLYYLCYCVEAZ-UHFFFAOYSA-N
Synonyms

COC(=O)C1=CN(C=C(C1C2=CC3=C(C=C2Br)OCO3)C(=O)OC)CC4=CC=C(C=C4)Cl
DIMETHYL4(6BROMO13BENZODIOXOL5YL)1((4CHLOROPHENYL)METHYL)4HPYRIDINE35DICARBOXYLATE
dimethyl4(6bromo13benzodioxol5yl)1(4chlorobenzyl)14dihydropyridine35dicarboxylate
InChI=1SC23H19BrClNO6c12922(27)161026(9133514(25)6413)1117(23(28)302)21(16)1571920(818(15)24)32123119h38101121H912H212H3
METHYL4(6BROMO(2HBENZO(D)13DIOXOLEN5YL))1((4CHLOROPHENYL)METHYL)5(METHOXYCARBONYL)14DIHYDROPYRIDINE3CARBOXYLATE
MFCD04056766
ZINC000002796712
ZINC2796712

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Available files

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