Vitas-M small molecule compound
(E)-[4-(benzyloxy)-3-methylphenyl]{2-(4-tert-butylphenyl)-1-[2-(dimethylammonio)ethyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Catalog ID
STL047356
SMILES C[NH+](CCN1C(c2ccc(cc2)C(C)(C)C)/C(=C(/c2ccc(c(c2)C)OCc2ccccc2)\[O-])/C(=O)C1=O)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 C33H38N2O4 MW 526.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H38N2O4/c1-22-20-25(14-17-27(22)39-21-23-10-8-7-9-11-23)30(36)28-29(24-12-15-26(16-13-24)33(2,3)4)35(19-18-34(5)6)32(38)31(28)37/h7-17,20,29,36H,18-19,21H2,1-6H3/b30-28+InChIKey
MXBJBVVZHLTTRH-SJCQXOIGSA-NSynonyms
489442-50-4(4E)5(4tertbutylphenyl)1(2(dimethylamino)ethyl)4(hydroxy(3methyl4phenylmethoxyphenyl)methylidene)pyrrolidine23dione
(4E)5(4TERTBUTYLPHENYL)1(2DIMETHYLAMINOETHYL)4(HYDROXY(3METHYL4PHENYLMETHOXYPHENYL)METHYLIDENE)PYRROLIDINE23DIONE
(E)(2(4TERTBUTYLPHENYL)1(2(DIMETHYLAZANIUMYL)ETHYL)45DIOXOPYRROLIDIN3YLIDENE)(3METHYL4PHENYLMETHOXYPHENYL)METHANOLATE
(E)(4(benzyloxy)3methylphenyl)(2(4tertbutylphenyl)1(2(dimethylammonio)ethyl)45dioxopyrrolidin3ylidene)methanolate
489442504
C(NH+)(CCN1C(c2ccc(cc2)C(C)(C)C)C(=C(c2ccc(c(c2)C)OCc2ccccc2)(O))C(=O)C1=O)C
CC1=C(C=CC(=C1)C(=C2C(N(C(=O)C2=O)CCN(C)C)C3=CC=C(C=C3)C(C)(C)C)O)OCC4=CC=CC=C4
InChI=1SC33H38N2O4c1222025(141727(22)392123108791123)30(36)2829(24121526(161324)33(23)4)35(191834(5)6)32(38)31(28)37h717202936H181921H216H3b3028+
MFCD18249052
ZINC000102883331
ZINC000102883334
Check stock
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