Vitas-M small molecule compound

7-[3-(cyclopentyloxy)-4-methoxyphenyl]-5-oxo-3-phenyl-4,5,6,7-tetrahydrothieno[3,2-b]pyridine-2-carboxylic acid

Catalog ID
STK693573
SMILES COc1ccc(cc1OC1CCCC1)C1CC(=O)Nc2c1sc(c2c1ccccc1)C(=O)O

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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 C26H25NO5S MW 463.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25NO5S/c1-31-19-12-11-16(13-20(19)32-17-9-5-6-10-17)18-14-21(28)27-23-22(15-7-3-2-4-8-15)25(26(29)30)33-24(18)23/h2-4,7-8,11-13,17-18H,5-6,9-10,14H2,1H3,(H,27,28)(H,29,30)
InChIKey
PGEHWXURYFUHGT-UHFFFAOYSA-N
Synonyms

7(3(cyclopentyloxy)4methoxyphenyl)5oxo3phenyl4567tetrahydrothieno(32b)pyridine2carboxylicacid
7(3cyclopentyloxy4methoxyphenyl)5oxo3phenyl67dihydro4Hthieno(32b)pyridine2carboxylicacid
COC1=C(C=C(C=C1)C2CC(=O)NC3=C2SC(=C3C4=CC=CC=C4)C(=O)O)OC5CCCC5
InChI=1SC26H25NO5Sc13119121116(1320(19)32179561017)181421(28)272322(157324815)25(26(29)30)3324(18)23h247811131718H5691014H21H3(H2728)(H2930)
MFCD12033637
ZINC000015107245
ZINC000015107248

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Available files

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