Vitas-M small molecule compound

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

Catalog ID
STK898062
SMILES CCOC(=O)c1c(NC2OC(=O)c3c2cccc3)sc(c1C)C(=O)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 C18H17NO6S MW 375.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17NO6S/c1-4-24-17(21)12-9(2)13(18(22)23-3)26-15(12)19-14-10-7-5-6-8-11(10)16(20)25-14/h5-8,14,19H,4H2,1-3H3
InChIKey
BIAVJYJXGPYVNR-UHFFFAOYSA-N
Synonyms

4ethyl2methyl3methyl5((3oxo13dihydro2benzofuran1yl)amino)thiophene24dicarboxylate
4Oethyl2Omethyl3methyl5((3oxo1H2benzofuran1yl)amino)thiophene24dicarboxylate
CCOC(=O)C1=C(SC(=C1C)C(=O)OC)NC2C3=CC=CC=C3C(=O)O2
InChI=1SC18H17NO6Sc142417(21)129(2)13(18(22)233)2615(12)191410756811(10)16(20)2514h581419H4H213H3
MFCD18172816
ZINC000044827133
ZINC000044827135

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Available files

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