Vitas-M small molecule compound

methyl 3-[3-hydroxy-4-oxo-6-(piperidin-1-ylmethyl)-4H-pyran-2-yl]-3-(thiophen-3-yl)propanoate

Catalog ID
STL422122
SMILES COC(=O)CC(c1oc(CN2CCCCC2)cc(=O)c1O)c1cscc1

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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 C19H23NO5S MW 377.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H23NO5S/c1-24-17(22)10-15(13-5-8-26-12-13)19-18(23)16(21)9-14(25-19)11-20-6-3-2-4-7-20/h5,8-9,12,15,23H,2-4,6-7,10-11H2,1H3
InChIKey
ICCDRDHSRJDLKI-UHFFFAOYSA-N
Synonyms
1630850-38-2
1630850382
COC(=O)CC(C1=CSC=C1)C2=C(C(=O)C=C(O2)CN3CCCCC3)O
InChI=1SC19H23NO5Sc12417(22)1015(1358261213)1918(23)16(21)914(2519)11206324720h589121523H24671011H21H3
methyl3(3hydroxy4oxo6(piperidin1ylmethyl)4Hpyran2yl)3(thiophen3yl)propanoate
methyl3(3hydroxy4oxo6(piperidin1ylmethyl)pyran2yl)3thiophen3ylpropanoate
MFCD28367907
ZINC000218327606
ZINC000218327691

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Available files

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