Vitas-M small molecule compound

ethyl 5-hydroxy-2-[(phenylsulfanyl)methyl]-1-benzofuran-3-carboxylate

Catalog ID
STK547482
SMILES CCOC(=O)c1c(CSc2ccccc2)oc2c1cc(O)cc2

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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 C18H16O4S MW 328.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16O4S/c1-2-21-18(20)17-14-10-12(19)8-9-15(14)22-16(17)11-23-13-6-4-3-5-7-13/h3-10,19H,2,11H2,1H3
InChIKey
QOMJXOZGZZSHKH-UHFFFAOYSA-N
Synonyms
100095-73-6
100095736
5HYDROXY2PHENYLSULFANYLMETHYLBENZOFURAN3CARBOXYLICACIDETHYLESTER
CCOC(=O)C1=C(OC2=C1C=C(C=C2)O)CSC3=CC=CC=C3
ethyl5hydroxy2((phenylsulfanyl)methyl)1benzofuran3carboxylate
ethyl5hydroxy2((phenylthio)methyl)benzofuran3carboxylate
ETHYL5HYDROXY2(PHENYLSULFANYLMETHYL)1BENZOFURAN3CARBOXYLATE
InChI=1SC18H16O4Sc122118(20)17141012(19)8915(14)2216(17)1123136435713h31019H211H21H3
MFCD01220958
ZINC000002206727
ZINC02206727
ZINC2206727

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Available files

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