Vitas-M small molecule compound

ethyl 3-{[(4-chlorophenoxy)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate

Catalog ID
STK772830
SMILES CCOC(=O)c1sc2c(c1NC(=O)COc1ccc(cc1)Cl)CCCC2

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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 C19H20ClNO4S MW 393.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20ClNO4S/c1-2-24-19(23)18-17(14-5-3-4-6-15(14)26-18)21-16(22)11-25-13-9-7-12(20)8-10-13/h7-10H,2-6,11H2,1H3,(H,21,22)
InChIKey
TXDRCRDPKIIRGC-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(C2=C(S1)CCCC2)NC(=O)COC3=CC=C(C=C3)Cl
ethyl3(((4chlorophenoxy)acetyl)amino)4567tetrahydro1benzothiophene2carboxylate
ethyl3((2(4chlorophenoxy)acetyl)amino)4567tetrahydro1benzothiophene2carboxylate
InChI=1SC19H20ClNO4Sc122419(23)1817(14534615(14)2618)2116(22)1125139712(20)81013h710H2611H21H3(H2122)
MFCD03820837
ZINC000001078458
ZINC01078458
ZINC1078458

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Available files

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