Vitas-M small molecule compound

ethyl (4Z)-4-(4-methoxybenzylidene)-2-methyl-1-(2-methylpropyl)-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate

Catalog ID
STK795139
SMILES CCOC(=O)C1=C(C)N(C(=O)/C/1=C\c1ccc(cc1)OC)CC(C)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 C20H25NO4 MW 343.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25NO4/c1-6-25-20(23)18-14(4)21(12-13(2)3)19(22)17(18)11-15-7-9-16(24-5)10-8-15/h7-11,13H,6,12H2,1-5H3/b17-11-
InChIKey
KMOWDNVGJQHOGD-BOPFTXTBSA-N
Synonyms

(Z)ethyl1isobutyl4(4methoxybenzylidene)2methyl5oxo45dihydro1Hpyrrole3carboxylate
CCOC(=O)C1=C(C)N(C(=O)C1=Cc1ccc(cc1)OC)CC(C)C
CCOC(=O)C1=C(N(C(=O)C1=CC2=CC=C(C=C2)OC)CC(C)C)C
ETHYL(4Z)4((4METHOXYPHENYL)METHYLIDENE)2METHYL1(2METHYLPROPYL)5OXOPYRROLE3CARBOXYLATE
ethyl(4Z)4(4methoxybenzylidene)2methyl1(2methylpropyl)5oxo45dihydro1Hpyrrole3carboxylate
ETHYL1ISOBUTYL4(4METHOXYBENZYLIDENE)2METHYL5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
InChI=1SC20H25NO4c162520(23)1814(4)21(1213(2)3)19(22)17(18)11157916(245)10815h71113H612H215H3b1711
MFCD00684435
ZINC000012413433
ZINC12413433

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.