Vitas-M small molecule compound

dimethyl 1-cyclopentyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3,5-dicarboxylate

Catalog ID
STK403271
SMILES COC(=O)C1=CN(C=C(C1c1cccs1)C(=O)OC)C1CCCC1

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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 C18H21NO4S MW 347.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21NO4S/c1-22-17(20)13-10-19(12-6-3-4-7-12)11-14(18(21)23-2)16(13)15-8-5-9-24-15/h5,8-12,16H,3-4,6-7H2,1-2H3
InChIKey
SMWUBLMJEVIJPG-UHFFFAOYSA-N
Synonyms

COC(=O)C1=CN(C=C(C1C2=CC=CS2)C(=O)OC)C3CCCC3
dimethyl1cyclopentyl4(thiophen2yl)14dihydropyridine35dicarboxylate
DIMETHYL1CYCLOPENTYL4THIOPHEN2YL4HPYRIDINE35DICARBOXYLATE
InChI=1SC18H21NO4Sc12217(20)131019(12634712)1114(18(21)232)16(13)158592415h581216H3467H212H3
MFCD03312506
ZINC000000105560
ZINC00105560
ZINC105560

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Available files

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