Vitas-M small molecule compound
methyl 2-[(3E)-3-{[4-(benzyloxy)-3-methylphenyl](hydroxy)methylidene}-2-(4-ethoxy-3-methoxyphenyl)-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STK566886
SMILES CCOc1ccc(cc1OC)C1N(c2nc(c(s2)C(=O)OC)C)C(=O)C(=O)/C/1=C(\c1ccc(c(c1)C)OCc1ccccc1)/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 C34H32N2O8S MW 628.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H32N2O8S/c1-6-43-25-15-12-22(17-26(25)41-4)28-27(30(38)32(39)36(28)34-35-20(3)31(45-34)33(40)42-5)29(37)23-13-14-24(19(2)16-23)44-18-21-10-8-7-9-11-21/h7-17,28,37H,6,18H2,1-5H3/b29-27+InChIKey
DKDFIBVSLPAKMF-ORIPQNMZSA-NSynonyms
CCOC1=C(C=C(C=C1)C2C(=C(C3=CC(=C(C=C3)OCC4=CC=CC=C4)C)O)C(=O)C(=O)N2C5=NC(=C(S5)C(=O)OC)C)OC
CCOc1ccc(cc1OC)C1N(c2nc(c(s2)C(=O)OC)C)C(=O)C(=O)C1=C(c1ccc(c(c1)C)OCc1ccccc1)O
InChI=1SC34H32N2O8Sc164325151222(1726(25)414)2827(30(38)32(39)36(28)343520(3)31(4534)33(40)425)29(37)23131424(19(2)1623)441821108791121h7172837H618H215H3b2927+
METHYL2((3E)2(4ETHOXY3METHOXYPHENYL)3(HYDROXY(3METHYL4PHENYLMETHOXYPHENYL)METHYLIDENE)45DIOXOPYRROLIDIN1YL)4METHYL13THIAZOLE5CARBOXYLATE
methyl2((3E)3((4(benzyloxy)3methylphenyl)(hydroxy)methylidene)2(4ethoxy3methoxyphenyl)45dioxopyrrolidin1yl)4methyl13thiazole5carboxylate
MFCD05725696
ZINC000102650739
ZINC000102650741
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.