Vitas-M small molecule compound

diethyl 2-{[(4-chlorophenoxy)acetyl]amino}-4,7-dihydrothieno[2,3-c]pyridine-3,6(5H)-dicarboxylate

Catalog ID
STK011470
SMILES CCOC(=O)c1c(NC(=O)COc2ccc(cc2)Cl)sc2c1CCN(C2)C(=O)OCC

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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 C21H23ClN2O6S MW 466.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23ClN2O6S/c1-3-28-20(26)18-15-9-10-24(21(27)29-4-2)11-16(15)31-19(18)23-17(25)12-30-14-7-5-13(22)6-8-14/h5-8H,3-4,9-12H2,1-2H3,(H,23,25)
InChIKey
KPSHNWOSSDLYOC-UHFFFAOYSA-N
Synonyms
6050-98-2
6050982
CCOC(=O)C1=C(SC2=C1CCN(C2)C(=O)OCC)NC(=O)COC3=CC=C(C=C3)Cl
CCOC(=O)c1c(NC(=O)COc2ccc(cc2)Cl)sc2c1CCN(C2)C(=O)OCC
DIETHYL2(((4CHLOROPHENOXY)ACETYL)AMINO)47DIHYDROTHIENO(23C)PYRIDINE36(5H)DICARBOXYLATE
DIETHYL2((2(4CHLOROPHENOXY)ACETYL)AMINO)57DIHYDRO4HTHIENO(23C)PYRIDINE36DICARBOXYLATE
DIETHYL2(2(4CHLOROPHENOXY)ACETAMIDO)45DIHYDROTHIENO(23C)PYRIDINE36(7H)DICARBOXYLATE
InChI=1SC21H23ClN2O6Sc132820(26)181591024(21(27)2942)1116(15)3119(18)2317(25)1230147513(22)6814h58H34912H212H3(H2325)
MFCD01825445
STK011470
ZINC000001080999
ZINC01080999
ZINC1080999

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Available files

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