Vitas-M small molecule compound

ethyl 2-[(3E)-3-[(4-ethoxyphenyl)(hydroxy)methylidene]-4,5-dioxo-2-(thiophen-2-yl)pyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate

Catalog ID
STL149671
SMILES CCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccs1)c1nc(c(s1)C(=O)OCC)C)/O

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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 C24H22N2O6S2 MW 498.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N2O6S2/c1-4-31-15-10-8-14(9-11-15)19(27)17-18(16-7-6-12-33-16)26(22(29)20(17)28)24-25-13(3)21(34-24)23(30)32-5-2/h6-12,18,27H,4-5H2,1-3H3/b19-17+
InChIKey
FNUROPJWKVNGCJ-HTXNQAPBSA-N
Synonyms
371213-52-4
371213524
CCOC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)C3=NC(=C(S3)C(=O)OCC)C)C4=CC=CS4)O
CCOc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1cccs1)c1nc(c(s1)C(=O)OCC)C)O
ethyl2((3E)3((4ethoxyphenyl)(hydroxy)methylidene)45dioxo2(thiophen2yl)pyrrolidin1yl)4methyl13thiazole5carboxylate
ETHYL2((4E)4((4ETHOXYPHENYL)HYDROXYMETHYLIDENE)23DIOXO5THIOPHEN2YLPYRROLIDIN1YL)4METHYL13THIAZOLE5CARBOXYLATE
ETHYL2(4((4ETHOXYPHENYL)CARBONYL)3HYDROXY2OXO5(2THIENYL)(3PYRROLINYL))4METHYL13THIAZOLE5CARBOXYLATE
InChI=1SC24H22N2O6S2c14311510814(91115)19(27)1718(1676123316)26(22(29)20(17)28)242513(3)21(3424)23(30)3252h6121827H45H213H3b1917+
MFCD03796603
ZINC000102929655
ZINC000102929656

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Available files

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