Vitas-M small molecule compound
prop-2-en-1-yl 2-{(3E)-2-(4-ethoxyphenyl)-3-[hydroxy(4-methoxy-2-methylphenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STK618309
SMILES C=CCOC(=O)c1sc(nc1C)N1C(c2ccc(cc2)OCC)/C(=C(/c2ccc(cc2C)OC)\O)/C(=O)C1=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 C29H28N2O7S MW 548.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28N2O7S/c1-6-14-38-28(35)26-17(4)30-29(39-26)31-23(18-8-10-19(11-9-18)37-7-2)22(25(33)27(31)34)24(32)21-13-12-20(36-5)15-16(21)3/h6,8-13,15,23,32H,1,7,14H2,2-5H3/b24-22+InChIKey
XDHOZAMELDILEI-ZNTNEXAZSA-NSynonyms
498535-86-7498535867
C=CCOC(=O)c1sc(nc1C)N1C(c2ccc(cc2)OCC)C(=C(c2ccc(cc2C)OC)O)C(=O)C1=O
CCOC1=CC=C(C=C1)C2C(=C(C3=C(C=C(C=C3)OC)C)O)C(=O)C(=O)N2C4=NC(=C(S4)C(=O)OCC=C)C
InChI=1SC29H28N2O7Sc16143828(35)2617(4)3029(3926)3123(1881019(11918)3772)22(25(33)27(31)34)24(32)21131220(365)1516(21)3h6813152332H1714H225H3b2422+
MFCD09797360
prop2en1yl2((3E)2(4ethoxyphenyl)3(hydroxy(4methoxy2methylphenyl)methylidene)45dioxopyrrolidin1yl)4methyl13thiazole5carboxylate
PROP2ENYL2((3E)2(4ETHOXYPHENYL)3(HYDROXY(4METHOXY2METHYLPHENYL)METHYLIDENE)45DIOXOPYRROLIDIN1YL)4METHYL13THIAZOLE5CARBOXYLATE
ZINC000101278098
ZINC000101278099
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.