Vitas-M small molecule compound
ethyl (4Z)-4-[3-methoxy-4-(prop-2-en-1-yloxy)benzylidene]-2-methyl-1-(4-methylphenyl)-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK698671
SMILES C=CCOc1ccc(cc1OC)/C=C\1/C(=C(N(C1=O)c1ccc(cc1)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 C26H27NO5 MW 433.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27NO5/c1-6-14-32-22-13-10-19(16-23(22)30-5)15-21-24(26(29)31-7-2)18(4)27(25(21)28)20-11-8-17(3)9-12-20/h6,8-13,15-16H,1,7,14H2,2-5H3/b21-15-InChIKey
KPGZVVWOJGLAQC-QNGOZBTKSA-NSynonyms
(Z)ethyl4(4(allyloxy)3methoxybenzylidene)2methyl5oxo1(ptolyl)45dihydro1Hpyrrole3carboxylate
C=CCOc1ccc(cc1OC)C=C1C(=C(N(C1=O)c1ccc(cc1)C)C)C(=O)OCC
CCOC(=O)C1=C(N(C(=O)C1=CC2=CC(=C(C=C2)OCC=C)OC)C3=CC=C(C=C3)C)C
ETHYL(4Z)4((3METHOXY4PROP2ENOXYPHENYL)METHYLIDENE)2METHYL1(4METHYLPHENYL)5OXOPYRROLE3CARBOXYLATE
ethyl(4Z)4(3methoxy4(prop2en1yloxy)benzylidene)2methyl1(4methylphenyl)5oxo45dihydro1Hpyrrole3carboxylate
InChI=1SC26H27NO5c16143222131019(1623(22)305)152124(26(29)3172)18(4)27(25(21)28)2011817(3)91220h68131516H1714H225H3b2115
MFCD01121745
ZINC000012413423
ZINC12413423
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