Vitas-M small molecule compound

methyl 2-[(3E)-3-[hydroxy(phenyl)methylidene]-2-(2-methoxyphenyl)-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate

Catalog ID
STK604030
SMILES COC(=O)c1sc(nc1C)N1C(=O)C(=O)/C(=C(\c2ccccc2)/O)/C1c1ccccc1OC

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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 C24H20N2O6S MW 464.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20N2O6S/c1-13-21(23(30)32-3)33-24(25-13)26-18(15-11-7-8-12-16(15)31-2)17(20(28)22(26)29)19(27)14-9-5-4-6-10-14/h4-12,18,27H,1-3H3/b19-17+
InChIKey
GVWANAFIIUZKGB-HTXNQAPBSA-N
Synonyms
371213-07-9
371213079
CC1=C(SC(=N1)N2C(C(=C(C3=CC=CC=C3)O)C(=O)C2=O)C4=CC=CC=C4OC)C(=O)OC
COC(=O)c1sc(nc1C)N1C(=O)C(=O)C(=C(c2ccccc2)O)C1c1ccccc1OC
InChI=1SC24H20N2O6Sc11321(23(30)323)3324(2513)2618(1511781216(15)312)17(20(28)22(26)29)19(27)1495461014h4121827H13H3b1917+
methyl2((3E)3(hydroxy(phenyl)methylidene)2(2methoxyphenyl)45dioxopyrrolidin1yl)4methyl13thiazole5carboxylate
METHYL2(3HYDROXY5(2METHOXYPHENYL)2OXO4(PHENYLCARBONYL)(3PYRROLINYL))4METHYL13THIAZOLE5CARBOXYLATE
MFCD08729512
ZINC000102696626
ZINC000102696632

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Available files

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