Vitas-M small molecule compound

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

Catalog ID
STK693611
SMILES O=C1CC(c2cccc(c2)OCC(=O)N)c2c(N1)c(c1ccccc1)c(s2)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 C22H18N2O5S MW 422.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18N2O5S/c23-16(25)11-29-14-8-4-7-13(9-14)15-10-17(26)24-19-18(12-5-2-1-3-6-12)21(22(27)28)30-20(15)19/h1-9,15H,10-11H2,(H2,23,25)(H,24,26)(H,27,28)
InChIKey
KLLQCRQEZJZTLR-UHFFFAOYSA-N
Synonyms

7(3(2amino2oxoethoxy)phenyl)5oxo3phenyl4567tetrahydrothieno(32b)pyridine2carboxylicacid
7(3(2amino2oxoethoxy)phenyl)5oxo3phenyl67dihydro4Hthieno(32b)pyridine2carboxylicacid
C1C(C2=C(C(=C(S2)C(=O)O)C3=CC=CC=C3)NC1=O)C4=CC(=CC=C4)OCC(=O)N
InChI=1SC22H18N2O5Sc2316(25)11291484713(914)151017(26)241918(125213612)21(22(27)28)3020(15)19h1915H1011H2(H22325)(H2426)(H2728)
MFCD12033695
ZINC000015107446
ZINC000015107449

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Available files

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