Vitas-M small molecule compound
methyl 2-{(3E)-3-[hydroxy(3-methoxyphenyl)methylidene]-2-[4-(methoxycarbonyl)phenyl]-4,5-dioxopyrrolidin-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STK628354
SMILES COc1cccc(c1)/C(=C\1/C(c2ccc(cc2)C(=O)OC)N(C(=O)C1=O)c1sc(c(n1)C)C(=O)OC)/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 C26H22N2O8S MW 522.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22N2O8S/c1-13-22(25(33)36-4)37-26(27-13)28-19(14-8-10-15(11-9-14)24(32)35-3)18(21(30)23(28)31)20(29)16-6-5-7-17(12-16)34-2/h5-12,19,29H,1-4H3/b20-18+InChIKey
UGOZAUKPDGRGJK-CZIZESTLSA-NSynonyms
609307-75-7609307757
CC1=C(SC(=N1)N2C(C(=C(C3=CC(=CC=C3)OC)O)C(=O)C2=O)C4=CC=C(C=C4)C(=O)OC)C(=O)OC
COc1cccc(c1)C(=C1C(c2ccc(cc2)C(=O)OC)N(C(=O)C1=O)c1sc(c(n1)C)C(=O)OC)O
InChI=1SC26H22N2O8Sc11322(25(33)364)3726(2713)2819(1481015(11914)24(32)353)18(21(30)23(28)31)20(29)1665717(1216)342h5121929H14H3b2018+
methyl2((3E)3(hydroxy(3methoxyphenyl)methylidene)2(4(methoxycarbonyl)phenyl)45dioxopyrrolidin1yl)4methyl13thiazole5carboxylate
METHYL2((3E)3(HYDROXY(3METHOXYPHENYL)METHYLIDENE)2(4METHOXYCARBONYLPHENYL)45DIOXOPYRROLIDIN1YL)4METHYL13THIAZOLE5CARBOXYLATE
METHYL4(4HYDROXY1(5(METHOXYCARBONYL)4METHYL(13THIAZOL2YL))3((3METHOXYPHENYL)CARBONYL)5OXO3PYRROLIN2YL)BENZOATE
MFCD09796712
ZINC000102731128
ZINC000102731131
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Check stock on Vitas-MAvailable files
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