Vitas-M small molecule compound
ethyl 2-[(3E)-3-[(4-ethoxyphenyl)(hydroxy)methylidene]-2-(4-methylphenyl)-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STK559570
SMILES CCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)C)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 C27H26N2O6S MW 506.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N2O6S/c1-5-34-19-13-11-18(12-14-19)22(30)20-21(17-9-7-15(3)8-10-17)29(25(32)23(20)31)27-28-16(4)24(36-27)26(33)35-6-2/h7-14,21,30H,5-6H2,1-4H3/b22-20+InChIKey
BPYCQVYUUVQHHO-LSDHQDQOSA-NSynonyms
384796-36-5384796365
CCOC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)C3=NC(=C(S3)C(=O)OCC)C)C4=CC=C(C=C4)C)O
CCOc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1ccc(cc1)C)c1nc(c(s1)C(=O)OCC)C)O
ethyl2((3E)3((4ethoxyphenyl)(hydroxy)methylidene)2(4methylphenyl)45dioxopyrrolidin1yl)4methyl13thiazole5carboxylate
ETHYL2((3E)3((4ETHOXYPHENYL)HYDROXYMETHYLIDENE)2(4METHYLPHENYL)45DIOXOPYRROLIDIN1YL)4METHYL13THIAZOLE5CARBOXYLATE
ETHYL2(4((4ETHOXYPHENYL)CARBONYL)3HYDROXY5(4METHYLPHENYL)2OXO(3PYRROLINYL))4METHYL13THIAZOLE5CARBOXYLATE
InChI=1SC27H26N2O6Sc153419131118(121419)22(30)2021(179715(3)81017)29(25(32)23(20)31)272816(4)24(3627)26(33)3562h7142130H56H214H3b2220+
MFCD03798451
ZINC000102488381
ZINC000102488390
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.