Vitas-M small molecule compound

ethyl 2-[(4,5-dimethoxy-3-oxo-1,3-dihydro-2-benzofuran-1-yl)amino]-4-methyl-5-(phenylcarbamoyl)thiophene-3-carboxylate

Catalog ID
STK582104
SMILES CCOC(=O)c1c(sc(c1C)C(=O)Nc1ccccc1)NC1OC(=O)c2c1ccc(c2OC)OC

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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 C25H24N2O7S MW 496.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N2O7S/c1-5-33-24(29)17-13(2)20(21(28)26-14-9-7-6-8-10-14)35-23(17)27-22-15-11-12-16(31-3)19(32-4)18(15)25(30)34-22/h6-12,22,27H,5H2,1-4H3,(H,26,28)
InChIKey
KGZNPWBFONUFIA-UHFFFAOYSA-N
Synonyms
799769-76-9
799769769
CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC=CC=C2)NC3C4=C(C(=C(C=C4)OC)OC)C(=O)O3
ethyl2((45dimethoxy3oxo13dihydro2benzofuran1yl)amino)4methyl5(phenylcarbamoyl)thiophene3carboxylate
ethyl2((45dimethoxy3oxo13dihydroisobenzofuran1yl)amino)4methyl5(phenylcarbamoyl)thiophene3carboxylate
ETHYL2((45DIMETHOXY3OXO1H2BENZOFURAN1YL)AMINO)4METHYL5(PHENYLCARBAMOYL)THIOPHENE3CARBOXYLATE
InChI=1SC25H24N2O7Sc153324(29)1713(2)20(21(28)261497681014)3523(17)272215111216(313)19(324)18(15)25(30)3422h6122227H5H214H3(H2628)
MFCD03671229
ZINC000002203552
ZINC000002203553

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Available files

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