Vitas-M small molecule compound

(2E)-1-(4-butoxyphenyl)-3-[(4-ethylphenyl)amino]prop-2-en-1-one

Catalog ID
STK902334
SMILES CCCCOc1ccc(cc1)C(=O)/C=C/Nc1ccc(cc1)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 C21H25NO2 MW 323.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25NO2/c1-3-5-16-24-20-12-8-18(9-13-20)21(23)14-15-22-19-10-6-17(4-2)7-11-19/h6-15,22H,3-5,16H2,1-2H3/b15-14+
InChIKey
FRIGDLWYZJYTMB-CCEZHUSRSA-N
Synonyms

(2E)1(4butoxyphenyl)3((4ethylphenyl)amino)prop2en1one
(E)1(4butoxyphenyl)3(4ethylanilino)prop2en1one
CCCCOC1=CC=C(C=C1)C(=O)C=CNC2=CC=C(C=C2)CC
CCCCOc1ccc(cc1)C(=O)C=CNc1ccc(cc1)CC
InChI=1SC21H25NO2c13516242012818(91320)21(23)1415221910617(42)71119h61522H3516H212H3b1514+
MFCD18174860
ZINC000044842906
ZINC44842906

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Available files

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