Vitas-M small molecule compound

(2E)-3-(2,6-dichlorophenyl)-N-(3,5-dimethylphenyl)prop-2-enamide

Catalog ID
STK420301
SMILES O=C(Nc1cc(C)cc(c1)C)/C=C/c1c(Cl)cccc1Cl

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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/c1-11-8-12(2)10-13(9-11)20-17(21)7-6-14-15(18)4-3-5-16(14)19/h3-10H,1-2H3,(H,20,21)/b7-6+
InChIKey
XBWHQNJVYFSYBH-VOTSOKGWSA-N
Synonyms
543722-27-6
(2E)3(26dichlorophenyl)N(35dimethylphenyl)prop2enamide
(E)3(26DICHLOROPHENYL)N(35DIMETHYLPHENYL)PROP2ENAMIDE
543722276
CC1=CC(=CC(=C1)NC(=O)C=CC2=C(C=CC=C2Cl)Cl)C
InChI=1SC17H15Cl2NOc111812(2)1013(911)2017(21)761415(18)43516(14)19h310H12H3(H2021)b76+
MFCD02054337
O=C(Nc1cc(C)cc(c1)C)C=Cc1c(Cl)cccc1Cl
ZINC000001939771
ZINC01939771
ZINC1939771

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Available files

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