Vitas-M small molecule compound

(2E)-2-cyano-N-cyclohexyl-3-(3,4-dichlorophenyl)prop-2-enamide

Catalog ID
STK809404
SMILES N#C/C(=C\c1ccc(c(c1)Cl)Cl)/C(=O)NC1CCCCC1

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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 C16H16Cl2N2O MW 323.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16Cl2N2O/c17-14-7-6-11(9-15(14)18)8-12(10-19)16(21)20-13-4-2-1-3-5-13/h6-9,13H,1-5H2,(H,20,21)/b12-8+
InChIKey
UVSYNAGPJCPNMK-XYOKQWHBSA-N
Synonyms

(2E)2cyanoNcyclohexyl3(34dichlorophenyl)prop2enamide
(E)2CYANONCYCLOHEXYL3(34DICHLOROPHENYL)PROP2ENAMIDE
C1CCC(CC1)NC(=O)C(=CC2=CC(=C(C=C2)Cl)Cl)C#N
InChI=1SC16H16Cl2N2Oc17147611(915(14)18)812(1019)16(21)20134213513h6913H15H2(H2021)b128+
MFCD01457761
N#CC(=Cc1ccc(c(c1)Cl)Cl)C(=O)NC1CCCCC1
ZINC000001450922
ZINC01450922
ZINC1450922

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Available files

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