Vitas-M small molecule compound
dimethyl 1-(1,3-benzodioxol-5-ylmethyl)-4-(thiophen-2-yl)-1,4-dihydropyridine-3,5-dicarboxylate
Catalog ID
STK087386
SMILES COC(=O)C1=CN(Cc2ccc3c(c2)OCO3)C=C(C1c1cccs1)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 C21H19NO6S MW 413.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19NO6S/c1-25-20(23)14-10-22(9-13-5-6-16-17(8-13)28-12-27-16)11-15(21(24)26-2)19(14)18-4-3-7-29-18/h3-8,10-11,19H,9,12H2,1-2H3InChIKey
TYPXECDKNDFALM-UHFFFAOYSA-NSynonyms
COC(=O)C1=CN(C=C(C1C2=CC=CS2)C(=O)OC)CC3=CC4=C(C=C3)OCO4
COC(=O)C1=CN(Cc2ccc3c(c2)OCO3)C=C(C1c1cccs1)C(=O)OC
DIMETHYL1(13BENZODIOXOL5YLMETHYL)4(THIOPHEN2YL)14DIHYDROPYRIDINE35DICARBOXYLATE
DIMETHYL1(13BENZODIOXOL5YLMETHYL)4THIOPHEN2YL4HPYRIDINE35DICARBOXYLATE
InChI=1SC21H19NO6Sc12520(23)141022(913561617(813)28122716)1115(21(24)262)19(14)184372918h38101119H912H212H3
METHYL1(2HBENZO(34D)13DIOXOLEN5YLMETHYL)5(METHOXYCARBONYL)4(2THIENYL)14DIHYDROPYRIDINE3CARBOXYLATE
MFCD02188771
STK087386
ZINC000001087775
ZINC01087775
ZINC1087775
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