Vitas-M small molecule compound

(2E)-3-[(2,5-dichlorophenyl)amino]-1-(4-ethylphenyl)prop-2-en-1-one

Catalog ID
STK026977
SMILES CCc1ccc(cc1)C(=O)/C=C/Nc1cc(Cl)ccc1Cl

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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 C17H15Cl2NO MW 320.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15Cl2NO/c1-2-12-3-5-13(6-4-12)17(21)9-10-20-16-11-14(18)7-8-15(16)19/h3-11,20H,2H2,1H3/b10-9+
InChIKey
SDLHTQAVTFSXEF-MDZDMXLPSA-N
Synonyms

(2E)3((25DICHLOROPHENYL)AMINO)1(4ETHYLPHENYL)PROP2EN1ONE
(E)3(25DICHLOROANILINO)1(4ETHYLPHENYL)PROP2EN1ONE
CCC1=CC=C(C=C1)C(=O)C=CNC2=C(C=CC(=C2)Cl)Cl
CCc1ccc(cc1)C(=O)C=CNc1cc(Cl)ccc1Cl
InChI=1SC17H15Cl2NOc12123513(6412)17(21)91020161114(18)7815(16)19h31120H2H21H3b109+
MFCD08050108
STK026977
ZINC000004592955
ZINC04592955
ZINC4592955

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Available files

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