Vitas-M small molecule compound
diethyl 4-(6-bromo-1,3-benzodioxol-5-yl)-1-(4-methoxybenzyl)-1,4-dihydropyridine-3,5-dicarboxylate
Catalog ID
STK403949
SMILES CCOC(=O)C1=CN(Cc2ccc(cc2)OC)C=C(C1c1cc2OCOc2cc1Br)C(=O)OCC
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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 C26H26BrNO7 MW 544.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26BrNO7/c1-4-32-25(29)19-13-28(12-16-6-8-17(31-3)9-7-16)14-20(26(30)33-5-2)24(19)18-10-22-23(11-21(18)27)35-15-34-22/h6-11,13-14,24H,4-5,12,15H2,1-3H3InChIKey
GJBJGWQPPSNISP-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CN(C=C(C1C2=CC3=C(C=C2Br)OCO3)C(=O)OCC)CC4=CC=C(C=C4)OC
DIETHYL4(6BROMO13BENZODIOXOL5YL)1((4METHOXYPHENYL)METHYL)4HPYRIDINE35DICARBOXYLATE
diethyl4(6bromo13benzodioxol5yl)1(4methoxybenzyl)14dihydropyridine35dicarboxylate
ETHYL4(6BROMO(2HBENZO(D)13DIOXOLEN5YL))5(ETHOXYCARBONYL)1((4METHOXYPHENYL)METHYL)14DIHYDROPYRIDINE3CARBOXYLATE
InChI=1SC26H26BrNO7c143225(29)191328(12166817(313)9716)1420(26(30)3352)24(19)18102223(1121(18)27)35153422h611131424H451215H213H3
MFCD03632712
ZINC000002797053
ZINC2797053
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