Vitas-M small molecule compound

ethyl 2-({[2-(diethylamino)ethyl]sulfanyl}methyl)-5-methoxy-1-benzofuran-3-carboxylate

Catalog ID
STK086695
SMILES CCOC(=O)c1c(CSCCN(CC)CC)oc2c1cc(OC)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 C19H27NO4S MW 365.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H27NO4S/c1-5-20(6-2)10-11-25-13-17-18(19(21)23-7-3)15-12-14(22-4)8-9-16(15)24-17/h8-9,12H,5-7,10-11,13H2,1-4H3
InChIKey
CORPGBHJCUPYKW-UHFFFAOYSA-N
Synonyms

CCN(CC)CCSCC1=C(C2=C(O1)C=CC(=C2)OC)C(=O)OCC
CCOC(=O)c1c(CSCCN(CC)CC)oc2c1cc(OC)cc2
CCOC(=O)c1c(CSCCN(CC)CC)oc2c1cc(OC)cc2OCl
ETHYL2(((2(DIETHYLAMINO)ETHYL)SULFANYL)METHYL)5METHOXY1BENZOFURAN3CARBOXYLATE
ethyl2(((2(diethylamino)ethyl)thio)methyl)5methoxybenzofuran3carboxylatehydrochloridehydrate
ethyl2(2(diethylamino)ethylsulfanylmethyl)5methoxy1benzofuran3carboxylate
ETHYL2(2DIETHYLAMINOETHYLSULFANYLMETHYL)5METHOXY1BENZOFURAN3CARBOXYLATE
InChI=1SC19H27NO4Sc1520(62)101125131718(19(21)2373)151214(224)8916(15)2417h8912H57101113H214H3
MFCD01557965
STK086695
ZINC000002208161
ZINC2208161

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Available files

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