Vitas-M small molecule compound

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

Catalog ID
STK913306
SMILES CCOC(=O)c1c(NC(=O)c2cc(=O)c3c(o2)ccc(c3)CC)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/c1-5-13-7-8-16-14(9-13)15(25)10-17(29-16)20(26)23-21-18(22(27)28-6-2)11(3)19(30-21)12(4)24/h7-10H,5-6H2,1-4H3,(H,23,26)
InChIKey
IQIPBVNVSNJEFW-UHFFFAOYSA-N
Synonyms
874356-19-1
874356191
CCC1=CC2=C(C=C1)OC(=CC2=O)C(=O)NC3=C(C(=C(S3)C(=O)C)C)C(=O)OCC
ethyl5acetyl2(((6ethyl4oxo4Hchromen2yl)carbonyl)amino)4methylthiophene3carboxylate
ethyl5acetyl2((6ethyl4oxochromene2carbonyl)amino)4methylthiophene3carboxylate
InChI=1SC22H21NO6Sc1513781614(913)15(25)1017(2916)20(26)232118(22(27)2862)11(3)19(3021)12(4)24h710H56H214H3(H2326)
MFCD07428257
ZINC000012062517
ZINC12062517

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Available files

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