Vitas-M small molecule compound

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

Catalog ID
STK765135
SMILES CCOC(=O)c1c(NC(=O)COc2ccc(cc2F)F)sc2c1CCC(C2)C

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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 C20H21F2NO4S MW 409.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21F2NO4S/c1-3-26-20(25)18-13-6-4-11(2)8-16(13)28-19(18)23-17(24)10-27-15-7-5-12(21)9-14(15)22/h5,7,9,11H,3-4,6,8,10H2,1-2H3,(H,23,24)
InChIKey
SKXRHBLTWOENGK-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC2=C1CCC(C2)C)NC(=O)COC3=C(C=C(C=C3)F)F
ethyl2(((24difluorophenoxy)acetyl)amino)6methyl4567tetrahydro1benzothiophene3carboxylate
ethyl2((2(24difluorophenoxy)acetyl)amino)6methyl4567tetrahydro1benzothiophene3carboxylate
InChI=1SC20H21F2NO4Sc132620(25)18136411(2)816(13)2819(18)2317(24)1027157512(21)914(15)22h57911H346810H212H3(H2324)
MFCD02933482
ZINC000000720612
ZINC000000720613

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Available files

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