Vitas-M small molecule compound
methyl (5E)-5-[4-(2-amino-2-oxoethoxy)benzylidene]-2-methyl-1-(4-methylphenyl)-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STL330611
SMILES COC(=O)C1=C(C)N(/C(=C/c2ccc(cc2)OCC(=O)N)/C1=O)c1ccc(cc1)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 C23H22N2O5 MW 406.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N2O5/c1-14-4-8-17(9-5-14)25-15(2)21(23(28)29-3)22(27)19(25)12-16-6-10-18(11-7-16)30-13-20(24)26/h4-12H,13H2,1-3H3,(H2,24,26)/b19-12+InChIKey
GVLQMQUZQKHLRZ-XDHOZWIPSA-NSynonyms
(Z)methyl5(4(2amino2oxoethoxy)benzylidene)2methyl4oxo1(ptolyl)45dihydro1Hpyrrole3carboxylate
CC1=CC=C(C=C1)N2C(=C(C(=O)C2=CC3=CC=C(C=C3)OCC(=O)N)C(=O)OC)C
COC(=O)C1=C(C)N(C(=Cc2ccc(cc2)OCC(=O)N)C1=O)c1ccc(cc1)C
InChI=1SC23H22N2O5c1144817(9514)2515(2)21(23(28)293)22(27)19(25)121661018(11716)301320(24)26h412H13H213H3(H22426)b1912+
METHYL(5E)5((4(2AMINO2OXOETHOXY)PHENYL)METHYLIDENE)2METHYL1(4METHYLPHENYL)4OXOPYRROLE3CARBOXYLATE
methyl(5E)5(4(2amino2oxoethoxy)benzylidene)2methyl1(4methylphenyl)4oxo45dihydro1Hpyrrole3carboxylate
MFCD28031996
ZINC000005784160
ZINC05784160
ZINC5784160
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