Vitas-M small molecule compound
dimethyl 4-(1,3-benzodioxol-5-yl)-1-(thiophen-2-ylmethyl)-1,4-dihydropyridine-3,5-dicarboxylate
Catalog ID
STK078704
SMILES COC(=O)C1=CN(Cc2cccs2)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 C21H19NO6S MW 413.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19NO6S/c1-25-20(23)15-10-22(9-14-4-3-7-29-14)11-16(21(24)26-2)19(15)13-5-6-17-18(8-13)28-12-27-17/h3-8,10-11,19H,9,12H2,1-2H3InChIKey
PWPJZIAHYYQKQB-UHFFFAOYSA-NSynonyms
COC(=O)C1=CN(C=C(C1C2=CC3=C(C=C2)OCO3)C(=O)OC)CC4=CC=CS4
COC(=O)C1=CN(Cc2cccs2)C=C(C1c1ccc2c(c1)OCO2)C(=O)OC
DIMETHYL4(13BENZODIOXOL5YL)1(THIOPHEN2YLMETHYL)14DIHYDROPYRIDINE35DICARBOXYLATE
DIMETHYL4(13BENZODIOXOL5YL)1(THIOPHEN2YLMETHYL)4HPYRIDINE35DICARBOXYLATE
InChI=1SC21H19NO6Sc12520(23)151022(9144372914)1116(21(24)262)19(15)13561718(813)28122717h38101119H912H212H3
METHYL4(2HBENZO(34D)13DIOXOLEN5YL)5(METHOXYCARBONYL)1(2THIENYLMETHYL)14DIHYDROPYRIDINE3CARBOXYLATE
MFCD02105329
STK078704
ZINC000000781167
ZINC00781167
ZINC781167
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