Vitas-M small molecule compound
ethyl (4Z)-1-(3,4-dimethylphenyl)-4-(3-ethoxy-4-propoxybenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK760033
SMILES CCCOc1ccc(cc1OCC)/C=C\1/C(=C(N(C1=O)c1ccc(c(c1)C)C)C)C(=O)OCC
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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 C28H33NO5 MW 463.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H33NO5/c1-7-14-34-24-13-11-21(17-25(24)32-8-2)16-23-26(28(31)33-9-3)20(6)29(27(23)30)22-12-10-18(4)19(5)15-22/h10-13,15-17H,7-9,14H2,1-6H3/b23-16-InChIKey
VABZPYNIRMYRCE-KQWNVCNZSA-NSynonyms
(Z)ethyl1(34dimethylphenyl)4(3ethoxy4propoxybenzylidene)2methyl5oxo45dihydro1Hpyrrole3carboxylate
CCCOC1=C(C=C(C=C1)C=C2C(=C(N(C2=O)C3=CC(=C(C=C3)C)C)C)C(=O)OCC)OCC
CCCOc1ccc(cc1OCC)C=C1C(=C(N(C1=O)c1ccc(c(c1)C)C)C)C(=O)OCC
ETHYL(4Z)1(34DIMETHYLPHENYL)4((3ETHOXY4PROPOXYPHENYL)METHYLIDENE)2METHYL5OXOPYRROLE3CARBOXYLATE
ethyl(4Z)1(34dimethylphenyl)4(3ethoxy4propoxybenzylidene)2methyl5oxo45dihydro1Hpyrrole3carboxylate
ETHYL1(34DIMETHYLPHENYL)4(3ETHOXY4PROPOXYBENZYLIDENE)2METHYL5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
InChI=1SC28H33NO5c17143424131121(1725(24)3282)162326(28(31)3393)20(6)29(27(23)30)22121018(4)19(5)1522h10131517H7914H216H3b2316
MFCD01571708
ZINC000002303592
ZINC02303592
ZINC2303592
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