Vitas-M small molecule compound

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

Catalog ID
STL255598
SMILES COc1ccccc1OC(C(=O)Nc1sc2c(c1C(=O)OC)CCCC2)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 C20H23NO5S MW 389.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23NO5S/c1-12(26-15-10-6-5-9-14(15)24-2)18(22)21-19-17(20(23)25-3)13-8-4-7-11-16(13)27-19/h5-6,9-10,12H,4,7-8,11H2,1-3H3,(H,21,22)
InChIKey
BLTPJDROFZIGDO-UHFFFAOYSA-N
Synonyms

CC(C(=O)NC1=C(C2=C(S1)CCCC2)C(=O)OC)OC3=CC=CC=C3OC
InChI=1SC20H23NO5Sc112(26151065914(15)242)18(22)211917(20(23)253)138471116(13)2719h5691012H47811H213H3(H2122)
methyl2((2(2methoxyphenoxy)propanoyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2(2(2methoxyphenoxy)propanamido)4567tetrahydrobenzo(b)thiophene3carboxylate
methyl2(2(2methoxyphenoxy)propanoylamino)4567tetrahydro1benzothiophene3carboxylate
MFCD02995971
ZINC000001144944
ZINC000001144946

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Available files

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