Vitas-M small molecule compound

(2E)-3-(2-chlorophenyl)-N-(pentan-2-yl)prop-2-enamide

Catalog ID
STK021602
SMILES CCCC(NC(=O)/C=C/c1ccccc1Cl)C

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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 C14H18ClNO MW 251.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H18ClNO/c1-3-6-11(2)16-14(17)10-9-12-7-4-5-8-13(12)15/h4-5,7-11H,3,6H2,1-2H3,(H,16,17)/b10-9+
InChIKey
WEKQAIGQGHZRAC-MDZDMXLPSA-N
Synonyms
349433-73-4
(2E)3(2CHLOROPHENYL)N(METHYLBUTYL)PROP2ENAMIDE
(2E)3(2CHLOROPHENYL)N(PENTAN2YL)PROP2ENAMIDE
(E)3(2CHLOROPHENYL)NPENTAN2YLPROP2ENAMIDE
349433734
CCCC(C)NC(=O)C=CC1=CC=CC=C1Cl
CCCC(NC(=O)C=Cc1ccccc1Cl)C
InChI=1SC14H18ClNOc13611(2)1614(17)10912745813(12)15h45711H36H212H3(H1617)b109+
MFCD02860902
STK021602
ZINC000004590680
ZINC000004590683

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Available files

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