Vitas-M small molecule compound

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

Catalog ID
STK402047
SMILES CCOC(=O)c1c(NC(=O)c2c(OC)cccc2OC)sc2c1CCCC2

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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/c1-4-26-20(23)16-12-8-5-6-11-15(12)27-19(16)21-18(22)17-13(24-2)9-7-10-14(17)25-3/h7,9-10H,4-6,8,11H2,1-3H3,(H,21,22)
InChIKey
DCODGLSBZMACKR-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=C(C=CC=C3OC)OC
ethyl2(((26dimethoxyphenyl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((26dimethoxybenzoyl)amino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC20H23NO5Sc142620(23)16128561115(12)2719(16)2118(22)1713(242)971014(17)253h7910H46811H213H3(H2122)
MFCD01338501
ZINC000000650196
ZINC00650196
ZINC650196

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Available files

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