Vitas-M small molecule compound

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

Catalog ID
STK279473
SMILES CCOC(=O)c1c(NC(=O)CSc2ccccc2)sc2c1CCCC2=O

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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 C19H19NO4S2 MW 389.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19NO4S2/c1-2-24-19(23)16-13-9-6-10-14(21)17(13)26-18(16)20-15(22)11-25-12-7-4-3-5-8-12/h3-5,7-8H,2,6,9-11H2,1H3,(H,20,22)
InChIKey
CXDDLBQTIALQTD-UHFFFAOYSA-N
Synonyms
299962-51-9
299962519
CCOC(=O)C1=C(SC2=C1CCCC2=O)NC(=O)CSC3=CC=CC=C3
ethyl7oxo2(((phenylsulfanyl)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate
ETHYL7OXO2((2PHENYLSULFANYLACETYL)AMINO)56DIHYDRO4H1BENZOTHIOPHENE3CARBOXYLATE
ETHYL7OXO2(2PHENYLTHIOACETYLAMINO)456TRIHYDROBENZO(B)THIOPHENE3CARBOXYLATE
InChI=1SC19H19NO4S2c122419(23)1613961014(21)17(13)2618(16)2015(22)1125127435812h3578H26911H21H3(H2022)
MFCD00544453
ZINC000000704416
ZINC00704416
ZINC704416

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Available files

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