Vitas-M small molecule compound

ethyl 5-hydroxy-2-{[(4-methylphenyl)sulfanyl]methyl}-1-benzofuran-3-carboxylate

Catalog ID
STK027542
SMILES CCOC(=O)c1c(CSc2ccc(cc2)C)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 C19H18O4S MW 342.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18O4S/c1-3-22-19(21)18-15-10-13(20)6-9-16(15)23-17(18)11-24-14-7-4-12(2)5-8-14/h4-10,20H,3,11H2,1-2H3
InChIKey
QOKRJIBOZKKPGI-UHFFFAOYSA-N
Synonyms
172421-69-1
172421691
5HYDROXY2(((4METHYLPHENYL)THIO)METHYL)3BENZOFURANCARBOXYLICACIDETHYLESTER
5HYDROXY2((PTOLYLTHIO)METHYL)BENZOFURAN3CARBOXYLICACIDETHYLESTER
5HYDROXY2PTOLYLSULFANYLMETHYLBENZOFURAN3CARBOXYLICACIDETHYLESTER
CCOC(=O)C1=C(OC2=C1C=C(C=C2)O)CSC3=CC=C(C=C3)C
CCOC(=O)c1c(CSc2ccc(cc2)C)oc2c1cc(O)cc2
ETHYL2((4METHYLPHENYL)SULFANYLMETHYL)5OXIDANYL1BENZOFURAN3CARBOXYLATE
ETHYL5HYDROXY2(((4METHYLPHENYL)SULFANYL)METHYL)1BENZOFURAN3CARBOXYLATE
ETHYL5HYDROXY2((4METHYLPHENYL)SULFANYLMETHYL)1BENZOFURAN3CARBOXYLATE
ethyl5hydroxy2((ptolylthio)methyl)benzofuran3carboxylate
InChI=1SC19H18O4Sc132219(21)18151013(20)6916(15)2317(18)1124147412(2)5814h41020H311H212H3
MFCD01557549
STK027542
ZINC000000495777
ZINC00495777
ZINC495777

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Available files

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