Vitas-M small molecule compound
(4E)-5-(4-tert-butylphenyl)-4-[hydroxy(4-methoxyphenyl)methylidene]-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione
Catalog ID
STK853341
SMILES COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)C(C)(C)C)Cc1cccnc1)/O
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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 C28H28N2O4 MW 456.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N2O4/c1-28(2,3)21-11-7-19(8-12-21)24-23(25(31)20-9-13-22(34-4)14-10-20)26(32)27(33)30(24)17-18-6-5-15-29-16-18/h5-16,24,31H,17H2,1-4H3/b25-23+InChIKey
MJCAWNYYDCSLIU-WJTDDFOZSA-NSynonyms
(4E)5(4tertbutylphenyl)4(hydroxy(4methoxyphenyl)methylidene)1(pyridin3ylmethyl)pyrrolidine23dione
CC(C)(C)C1=CC=C(C=C1)C2C(=C(C3=CC=C(C=C3)OC)O)C(=O)C(=O)N2CC4=CN=CC=C4
COc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1ccc(cc1)C(C)(C)C)Cc1cccnc1)O
InChI=1SC28H28N2O4c128(23)2111719(81221)2423(25(31)2091322(344)141020)26(32)27(33)30(24)17186515291618h5162431H17H214H3b2523+
MFCD08734755
ZINC000102802784
ZINC000102802786
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