Vitas-M small molecule compound
(E)-{2-(4-tert-butylphenyl)-1-[2-(diethylammonio)ethyl]-4,5-dioxopyrrolidin-3-ylidene}(4-methylphenyl)methanolate
Catalog ID
STL045160
SMILES CC[NH+](CCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)C)/[O-])/C1c1ccc(cc1)C(C)(C)C)CC
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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 C28H36N2O3 MW 448.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H36N2O3/c1-7-29(8-2)17-18-30-24(20-13-15-22(16-14-20)28(4,5)6)23(26(32)27(30)33)25(31)21-11-9-19(3)10-12-21/h9-16,24,31H,7-8,17-18H2,1-6H3/b25-23+InChIKey
MPXDNGCESKKRIU-WJTDDFOZSA-NSynonyms
636992-14-8(4E)5(4tertbutylphenyl)1(2(diethylamino)ethyl)4(hydroxy(4methylphenyl)methylidene)pyrrolidine23dione
(4E)5(4TERTBUTYLPHENYL)1(2DIETHYLAMINOETHYL)4(HYDROXY(4METHYLPHENYL)METHYLIDENE)PYRROLIDINE23DIONE
(E)(2(4tertbutylphenyl)1(2(diethylammonio)ethyl)45dioxopyrrolidin3ylidene)(4methylphenyl)methanolate
(E)(2(4TERTBUTYLPHENYL)1(2(DIETHYLAZANIUMYL)ETHYL)45DIOXOPYRROLIDIN3YLIDENE)(4METHYLPHENYL)METHANOLATE
1(2(DIETHYLAMINO)ETHYL)5(4(TERTBUTYL)PHENYL)3HYDROXY4((4METHYLPHENYL)CARBONYL)3PYRROLIN2ONE
636992148
CC(NH+)(CCN1C(=O)C(=O)C(=C(c2ccc(cc2)C)(O))C1c1ccc(cc1)C(C)(C)C)CC
CCN(CC)CCN1C(C(=C(C2=CC=C(C=C2)C)O)C(=O)C1=O)C3=CC=C(C=C3)C(C)(C)C
InChI=1SC28H36N2O3c1729(82)17183024(20131522(161420)28(45)6)23(26(32)27(30)33)25(31)2111919(3)101221h9162431H781718H216H3b2523+
MFCD18248578
ZINC000008980970
ZINC000102876707
Check stock
See real-time availability and sample size for STL045160 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
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