Vitas-M small molecule compound

dimethyl 4-(1,3-benzodioxol-5-yl)-1-[2-(2,4-dichlorophenyl)ethyl]-1,4-dihydropyridine-3,5-dicarboxylate

Catalog ID
STK406116
SMILES COC(=O)C1=CN(CCc2ccc(cc2Cl)Cl)C=C(C1c1ccc2c(c1)OCO2)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 C24H21Cl2NO6 MW 490.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21Cl2NO6/c1-30-23(28)17-11-27(8-7-14-3-5-16(25)10-19(14)26)12-18(24(29)31-2)22(17)15-4-6-20-21(9-15)33-13-32-20/h3-6,9-12,22H,7-8,13H2,1-2H3
InChIKey
YWMRWYCTOATCGS-UHFFFAOYSA-N
Synonyms

COC(=O)C1=CN(C=C(C1C2=CC3=C(C=C2)OCO3)C(=O)OC)CCC4=C(C=C(C=C4)Cl)Cl
dimethyl4(13benzodioxol5yl)1(2(24dichlorophenyl)ethyl)14dihydropyridine35dicarboxylate
DIMETHYL4(13BENZODIOXOL5YL)1(2(24DICHLOROPHENYL)ETHYL)4HPYRIDINE35DICARBOXYLATE
InChI=1SC24H21Cl2NO6c13023(28)171127(87143516(25)1019(14)26)1218(24(29)312)22(17)15462021(915)33133220h3691222H7813H212H3
METHYL4(2HBENZO(34D)13DIOXOLEN5YL)1(2(24DICHLOROPHENYL)ETHYL)5(METHOXYCARBONYL)14DIHYDROPYRIDINE3CARBOXYLATE
MFCD05987017
ZINC000001132864
ZINC01132864
ZINC1132864

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.