Vitas-M small molecule compound
ethyl (4Z)-4-(3-ethoxy-4-propoxybenzylidene)-2-methyl-1-(4-methylphenyl)-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK804860
SMILES CCCOc1ccc(cc1OCC)/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 C27H31NO5 MW 449.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H31NO5/c1-6-15-33-23-14-11-20(17-24(23)31-7-2)16-22-25(27(30)32-8-3)19(5)28(26(22)29)21-12-9-18(4)10-13-21/h9-14,16-17H,6-8,15H2,1-5H3/b22-16-InChIKey
KEPKZZVKKFLNCC-JWGURIENSA-NSynonyms
(Z)ethyl4(3ethoxy4propoxybenzylidene)2methyl5oxo1(ptolyl)45dihydro1Hpyrrole3carboxylate
CCCOC1=C(C=C(C=C1)C=C2C(=C(N(C2=O)C3=CC=C(C=C3)C)C)C(=O)OCC)OCC
CCCOc1ccc(cc1OCC)C=C1C(=C(N(C1=O)c1ccc(cc1)C)C)C(=O)OCC
ETHYL(4Z)4((3ETHOXY4PROPOXYPHENYL)METHYLIDENE)2METHYL1(4METHYLPHENYL)5OXOPYRROLE3CARBOXYLATE
ethyl(4Z)4(3ethoxy4propoxybenzylidene)2methyl1(4methylphenyl)5oxo45dihydro1Hpyrrole3carboxylate
ETHYL4(3ETHOXY4PROPOXYBENZYLIDENE)2METHYL1(4METHYLPHENYL)5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
InChI=1SC27H31NO5c16153323141120(1724(23)3172)162225(27(30)3283)19(5)28(26(22)29)2112918(4)101321h9141617H6815H215H3b2216
MFCD02623629
ZINC000002174106
ZINC02174106
ZINC2174106
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