Vitas-M small molecule compound
methyl 2-[(3E)-3-[(3-chloro-4-methoxyphenyl)(hydroxy)methylidene]-2-(4-methylphenyl)-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STL147585
SMILES COC(=O)c1sc(nc1C)N1C(=O)C(=O)/C(=C(\c2ccc(c(c2)Cl)OC)/O)/C1c1ccc(cc1)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 C25H21ClN2O6S MW 512.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21ClN2O6S/c1-12-5-7-14(8-6-12)19-18(20(29)15-9-10-17(33-3)16(26)11-15)21(30)23(31)28(19)25-27-13(2)22(35-25)24(32)34-4/h5-11,19,29H,1-4H3/b20-18+InChIKey
UDIJWRISALJRFP-CZIZESTLSA-NSynonyms
636992-30-8636992308
CC1=CC=C(C=C1)C2C(=C(C3=CC(=C(C=C3)OC)Cl)O)C(=O)C(=O)N2C4=NC(=C(S4)C(=O)OC)C
COC(=O)c1sc(nc1C)N1C(=O)C(=O)C(=C(c2ccc(c(c2)Cl)OC)O)C1c1ccc(cc1)C
InChI=1SC25H21ClN2O6Sc1125714(8612)1918(20(29)1591017(333)16(26)1115)21(30)23(31)28(19)252713(2)22(3525)24(32)344h5111929H14H3b2018+
methyl2((3E)3((3chloro4methoxyphenyl)(hydroxy)methylidene)2(4methylphenyl)45dioxopyrrolidin1yl)4methyl13thiazole5carboxylate
METHYL2((3E)3((3CHLORO4METHOXYPHENYL)HYDROXYMETHYLIDENE)2(4METHYLPHENYL)45DIOXOPYRROLIDIN1YL)4METHYL13THIAZOLE5CARBOXYLATE
METHYL2(4((3CHLORO4METHOXYPHENYL)CARBONYL)3HYDROXY5(4METHYLPHENYL)2OXO(3PYRROLINYL))4METHYL13THIAZOLE5CARBOXYLATE
MFCD03813091
ZINC000102924826
ZINC000102924828
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.