Vitas-M small molecule compound

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

Catalog ID
STK693537
SMILES CSc1ccc(cc1)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 C21H17NO3S2 MW 395.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17NO3S2/c1-26-14-9-7-12(8-10-14)15-11-16(23)22-18-17(13-5-3-2-4-6-13)20(21(24)25)27-19(15)18/h2-10,15H,11H2,1H3,(H,22,23)(H,24,25)
InChIKey
ZOOVOYOUCUNAPN-UHFFFAOYSA-N
Synonyms

7(4(methylsulfanyl)phenyl)5oxo3phenyl4567tetrahydrothieno(32b)pyridine2carboxylicacid
7(4methylsulfanylphenyl)5oxo3phenyl67dihydro4Hthieno(32b)pyridine2carboxylicacid
CSC1=CC=C(C=C1)C2CC(=O)NC3=C2SC(=C3C4=CC=CC=C4)C(=O)O
InChI=1SC21H17NO3S2c126149712(81014)151116(23)221817(135324613)20(21(24)25)2719(15)18h21015H11H21H3(H2223)(H2425)
MFCD12033607
ZINC000015107101
ZINC000015107104

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Available files

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