Vitas-M small molecule compound

2-chloro-3-[(2,3-dimethylcyclohexyl)amino]naphthalene-1,4-dione

Catalog ID
STK536298
SMILES CC1CCCC(C1C)NC1=C(Cl)C(=O)c2c(C1=O)cccc2

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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 C18H20ClNO2 MW 317.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20ClNO2/c1-10-6-5-9-14(11(10)2)20-16-15(19)17(21)12-7-3-4-8-13(12)18(16)22/h3-4,7-8,10-11,14,20H,5-6,9H2,1-2H3
InChIKey
XIHNLWGDKYFEFG-UHFFFAOYSA-N
Synonyms

2chloro3((23dimethylcyclohexyl)amino)naphthalene14dione
CC1CCCC(C1C)NC2=C(C(=O)C3=CC=CC=C3C2=O)Cl
InChI=1SC18H20ClNO2c11065914(11(10)2)201615(19)17(21)12734813(12)18(16)22h347810111420H569H212H3
MFCD02985832
ZINC000004812918
ZINC000239433188

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Available files

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