Vitas-M small molecule compound

tert-butyl {[(2Z)-3-oxo-2-(thiophen-2-ylmethylidene)-2,3-dihydro-1-benzofuran-6-yl]oxy}acetate

Catalog ID
STK992451
SMILES O=C(OC(C)(C)C)COc1ccc2c(c1)O/C(=C\c1cccs1)/C2=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 C19H18O5S MW 358.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18O5S/c1-19(2,3)24-17(20)11-22-12-6-7-14-15(9-12)23-16(18(14)21)10-13-5-4-8-25-13/h4-10H,11H2,1-3H3/b16-10-
InChIKey
XTCLXQBQEHZBOO-YBEGLDIGSA-N
Synonyms
623117-71-5
(Z)tertbutyl2((3oxo2(thiophen2ylmethylene)23dihydrobenzofuran6yl)oxy)acetate
623117715
CC(C)(C)OC(=O)COC1=CC2=C(C=C1)C(=O)C(=CC3=CC=CS3)O2
InChI=1SC19H18O5Sc119(23)2417(20)112212671415(912)2316(18(14)21)10135482513h410H11H213H3b1610
MFCD06295428
O=C(OC(C)(C)C)COc1ccc2c(c1)OC(=Cc1cccs1)C2=O
tertbutyl(((2Z)3oxo2(thiophen2ylmethylidene)23dihydro1benzofuran6yl)oxy)acetate
TERTBUTYL2(((2Z)3OXO2(THIOPHEN2YLMETHYLIDENE)1BENZOFURAN6YL)OXY)ACETATE
TERTBUTYL2(3OXO2(2THIENYLMETHYLENE)BENZO(34B)FURAN6YLOXY)ACETATE
ZINC000009576061
ZINC09576061
ZINC9576061

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Available files

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