Vitas-M small molecule compound

diethyl (2E)-2-[(1,6-dimethyl-2-phenyl-1H-indol-5-yl)amino]but-2-enedioate

Catalog ID
STK688403
SMILES CCOC(=O)/C(=C\C(=O)OCC)/Nc1cc2cc(n(c2cc1C)C)c1ccccc1

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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 C24H26N2O4 MW 406.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26N2O4/c1-5-29-23(27)15-20(24(28)30-6-2)25-19-13-18-14-22(17-10-8-7-9-11-17)26(4)21(18)12-16(19)3/h7-15,25H,5-6H2,1-4H3/b20-15+
InChIKey
YRJQYPAUKOKAQG-HMMYKYKNSA-N
Synonyms

CCOC(=O)C(=CC(=O)OCC)Nc1cc2cc(n(c2cc1C)C)c1ccccc1
CCOC(=O)C=C(C(=O)OCC)NC1=C(C=C2C(=C1)C=C(N2C)C3=CC=CC=C3)C
diethyl(2E)2((16dimethyl2phenyl1Hindol5yl)amino)but2enedioate
DIETHYL(E)2((16DIMETHYL2PHENYLINDOL5YL)AMINO)BUT2ENEDIOATE
InChI=1SC24H26N2O4c152923(27)1520(24(28)3062)251913181422(17108791117)26(4)21(18)1216(19)3h71525H56H214H3b2015+
MFCD07657526
ZINC000100215312
ZINC04709795
ZINC100215312

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Available files

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