Vitas-M small molecule compound

ethyl 5-acetyl-4-methyl-2-{[(4-oxo-4H-chromen-2-yl)carbonyl]amino}thiophene-3-carboxylate

Catalog ID
STK516764
SMILES CCOC(=O)c1c(NC(=O)c2cc(=O)c3c(o2)cccc3)sc(c1C)C(=O)C

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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 C20H17NO6S MW 399.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17NO6S/c1-4-26-20(25)16-10(2)17(11(3)22)28-19(16)21-18(24)15-9-13(23)12-7-5-6-8-14(12)27-15/h5-9H,4H2,1-3H3,(H,21,24)
InChIKey
XRAODXWSCQHCPJ-UHFFFAOYSA-N
Synonyms
897840-05-0
897840050
CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)C2=CC(=O)C3=CC=CC=C3O2
ethyl5acetyl4methyl2(((4oxo4Hchromen2yl)carbonyl)amino)thiophene3carboxylate
ethyl5acetyl4methyl2((4oxochromene2carbonyl)amino)thiophene3carboxylate
InChI=1SC20H17NO6Sc142620(25)1610(2)17(11(3)22)2819(16)2118(24)15913(23)12756814(12)2715h59H4H213H3(H2124)
MFCD08548711
ZINC000012062611
ZINC12062611

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Available files

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