Vitas-M small molecule compound

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

Catalog ID
STK124358
SMILES COc1ccc(cc1)OCC(=O)Nc1sc2c(c1C(=O)OC)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 C19H21NO5S MW 375.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21NO5S/c1-23-12-7-9-13(10-8-12)25-11-16(21)20-18-17(19(22)24-2)14-5-3-4-6-15(14)26-18/h7-10H,3-6,11H2,1-2H3,(H,20,21)
InChIKey
LUXADSMRESDXLK-UHFFFAOYSA-N
Synonyms
300559-60-8
300559608
COC1=CC=C(C=C1)OCC(=O)NC2=C(C3=C(S2)CCCC3)C(=O)OC
InChI=1SC19H21NO5Sc123127913(10812)251116(21)201817(19(22)242)14534615(14)2618h710H3611H212H3(H2021)
methyl2(((4methoxyphenoxy)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2((2(4methoxyphenoxy)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate
MFCD02080494
ZINC000000729792
ZINC00729792
ZINC729792

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Available files

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