Vitas-M small molecule compound

ethyl 5-acetyl-2-{[(6,8-dimethyl-4-oxo-4H-chromen-2-yl)carbonyl]amino}-4-methylthiophene-3-carboxylate

Catalog ID
STK518068
SMILES CCOC(=O)c1c(NC(=O)c2cc(=O)c3c(o2)c(C)cc(c3)C)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 C22H21NO6S MW 427.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21NO6S/c1-6-28-22(27)17-12(4)19(13(5)24)30-21(17)23-20(26)16-9-15(25)14-8-10(2)7-11(3)18(14)29-16/h7-9H,6H2,1-5H3,(H,23,26)
InChIKey
DXHYXESTVXMGBY-UHFFFAOYSA-N
Synonyms
896816-59-4
896816594
CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)C2=CC(=O)C3=CC(=CC(=C3O2)C)C
ethyl5acetyl2(((68dimethyl4oxo4Hchromen2yl)carbonyl)amino)4methylthiophene3carboxylate
ETHYL5ACETYL2((68DIMETHYL4OXOCHROMENE2CARBONYL)AMINO)4METHYLTHIOPHENE3CARBOXYLATE
InChI=1SC22H21NO6Sc162822(27)1712(4)19(13(5)24)3021(17)2320(26)16915(25)14810(2)711(3)18(14)2916h79H6H215H3(H2326)
MFCD06597220
ZINC000002208133
ZINC02208133
ZINC2208133

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Available files

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