Vitas-M small molecule compound
methyl (4Z)-2-methyl-1-(4-methylbenzyl)-5-oxo-4-[4-(prop-2-en-1-yloxy)benzylidene]-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK168441
SMILES C=CCOc1ccc(cc1)/C=C\1/C(=C(N(C1=O)Cc1ccc(cc1)C)C)C(=O)OC
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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 C25H25NO4 MW 403.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25NO4/c1-5-14-30-21-12-10-19(11-13-21)15-22-23(25(28)29-4)18(3)26(24(22)27)16-20-8-6-17(2)7-9-20/h5-13,15H,1,14,16H2,2-4H3/b22-15-InChIKey
OGZXKSOQJWVCRO-JCMHNJIXSA-NSynonyms
C=CCOc1ccc(cc1)C=C1C(=C(N(C1=O)Cc1ccc(cc1)C)C)C(=O)OC
CC1=CC=C(C=C1)CN2C(=C(C(=CC3=CC=C(C=C3)OCC=C)C2=O)C(=O)OC)C
InChI=1SC25H25NO4c15143021121019(111321)152223(25(28)294)18(3)26(24(22)27)16208617(2)7920h51315H11416H224H3b2215
METHYL(4Z)2METHYL1((4METHYLPHENYL)METHYL)5OXO4((4PROP2ENOXYPHENYL)METHYLIDENE)PYRROLE3CARBOXYLATE
METHYL(4Z)2METHYL1(4METHYLBENZYL)5OXO4(4(PROP2EN1YLOXY)BENZYLIDENE)45DIHYDRO1HPYRROLE3CARBOXYLATE
MFCD03269680
ZINC000002089271
ZINC02089271
ZINC2089271
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