Vitas-M small molecule compound

2-butyl-3-[(2,3-dimethylcyclohexyl)amino]-2,3-dihydro-1H-isoindol-1-one

Catalog ID
STK021138
SMILES CCCCN1C(=O)c2c(C1NC1CCCC(C1C)C)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 C20H30N2O MW 314.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H30N2O/c1-4-5-13-22-19(16-10-6-7-11-17(16)20(22)23)21-18-12-8-9-14(2)15(18)3/h6-7,10-11,14-15,18-19,21H,4-5,8-9,12-13H2,1-3H3
InChIKey
BZTJMQNXRYPGBG-UHFFFAOYSA-N
Synonyms

2BUTYL3((23DIMETHYLCYCLOHEXYL)AMINO)23DIHYDRO1HISOINDOL1ONE
2butyl3((23dimethylcyclohexyl)amino)3Hisoindol1one
CCCCN1C(=O)c2c(C1NC1CCCC(C1C)C)cccc2
CCCCN1C(C2=CC=CC=C2C1=O)NC3CCCC(C3C)C
InChI=1SC20H30N2Oc145132219(1610671117(16)20(22)23)2118128914(2)15(18)3h6710111415181921H45891213H213H3
MFCD03032856
STK021138
ZINC000009057172
ZINC000248208404

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Available files

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