Vitas-M small molecule compound
dimethyl 4-(5-methylthiophen-2-yl)-1-[2-(tricyclo[3.3.1.1~3,7~]dec-1-yloxy)ethyl]-1,4-dihydropyridine-3,5-dicarboxylate
Catalog ID
STK772747
SMILES COC(=O)C1=CN(CCOC23CC4CC(C3)CC(C2)C4)C=C(C1c1ccc(s1)C)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 C26H33NO5S MW 471.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H33NO5S/c1-16-4-5-22(33-16)23-20(24(28)30-2)14-27(15-21(23)25(29)31-3)6-7-32-26-11-17-8-18(12-26)10-19(9-17)13-26/h4-5,14-15,17-19,23H,6-13H2,1-3H3InChIKey
PWCCZSLYMYXLHY-UHFFFAOYSA-NSynonyms
CC1=CC=C(S1)C2C(=CN(C=C2C(=O)OC)CCOC34CC5CC(C3)CC(C5)C4)C(=O)OC
DIMETHYL1(2(1ADAMANTYLOXY)ETHYL)4(5METHYLTHIOPHEN2YL)4HPYRIDINE35DICARBOXYLATE
dimethyl4(5methylthiophen2yl)1(2(tricyclo(3311~37~)dec1yloxy)ethyl)14dihydropyridine35dicarboxylate
InChI=1SC26H33NO5Sc1164522(3316)2320(24(28)302)1427(1521(23)25(29)313)6732261117818(1226)1019(917)1326h451415171923H613H213H3
MFCD03820690
ZINC000004127321
ZINC04127321
ZINC4127321
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