Vitas-M small molecule compound
methyl (4Z)-1-benzyl-4-[3-methoxy-4-(prop-2-en-1-yloxy)benzylidene]-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STL296471
SMILES C=CCOc1ccc(cc1OC)/C=C/1\C(=O)N(C(=C1C(=O)OC)C)Cc1ccccc1
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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 C25H25NO5 MW 419.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25NO5/c1-5-13-31-21-12-11-19(15-22(21)29-3)14-20-23(25(28)30-4)17(2)26(24(20)27)16-18-9-7-6-8-10-18/h5-12,14-15H,1,13,16H2,2-4H3/b20-14-InChIKey
MOQNBUBSZRUUDT-ZHZULCJRSA-NSynonyms
(Z)methyl4(4(allyloxy)3methoxybenzylidene)1benzyl2methyl5oxo45dihydro1Hpyrrole3carboxylate
C=CCOc1ccc(cc1OC)C=C1C(=O)N(C(=C1C(=O)OC)C)Cc1ccccc1
CC1=C(C(=CC2=CC(=C(C=C2)OCC=C)OC)C(=O)N1CC3=CC=CC=C3)C(=O)OC
InChI=1SC25H25NO5c15133121121119(1522(21)293)142023(25(28)304)17(2)26(24(20)27)161897681018h5121415H11316H224H3b2014
METHYL(4Z)1BENZYL4((3METHOXY4PROP2ENOXYPHENYL)METHYLIDENE)2METHYL5OXOPYRROLE3CARBOXYLATE
methyl(4Z)1benzyl4(3methoxy4(prop2en1yloxy)benzylidene)2methyl5oxo45dihydro1Hpyrrole3carboxylate
MFCD01893936
ZINC000004857316
ZINC04857316
ZINC4857316
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