Vitas-M small molecule compound

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

Catalog ID
STK902345
SMILES CCCCOc1ccc(cc1)C(=O)/C=C/Nc1ccc(cc1)OCC

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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 C21H25NO3 MW 339.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25NO3/c1-3-5-16-25-20-10-6-17(7-11-20)21(23)14-15-22-18-8-12-19(13-9-18)24-4-2/h6-15,22H,3-5,16H2,1-2H3/b15-14+
InChIKey
WQZKPJJCHJTAPT-CCEZHUSRSA-N
Synonyms

(2E)1(4butoxyphenyl)3((4ethoxyphenyl)amino)prop2en1one
(E)1(4butoxyphenyl)3(4ethoxyanilino)prop2en1one
CCCCOC1=CC=C(C=C1)C(=O)C=CNC2=CC=C(C=C2)OCC
CCCCOc1ccc(cc1)C(=O)C=CNc1ccc(cc1)OCC
InChI=1SC21H25NO3c13516252010617(71120)21(23)1415221881219(13918)2442h61522H3516H212H3b1514+
MFCD18174871
ZINC000044842959
ZINC44842959

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Available files

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