Vitas-M small molecule compound

2-butyl-3-(1-methyl-1H-indol-3-yl)-2,3-dihydro-1H-isoindol-1-one

Catalog ID
STK256232
SMILES CCCCN1C(=O)c2c(C1c1cn(c3c1cccc3)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 C21H22N2O MW 318.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O/c1-3-4-13-23-20(16-10-5-6-11-17(16)21(23)24)18-14-22(2)19-12-8-7-9-15(18)19/h5-12,14,20H,3-4,13H2,1-2H3
InChIKey
OYLTTYYMURFJCC-UHFFFAOYSA-N
Synonyms

2butyl3(1methyl1Hindol3yl)23dihydro1Hisoindol1one
2butyl3(1methylindol3yl)3Hisoindol1one
CCCCN1C(C2=CC=CC=C2C1=O)C3=CN(C4=CC=CC=C43)C
InChI=1SC21H22N2Oc134132320(1610561117(16)21(23)24)181422(2)191287915(18)19h5121420H3413H212H3
MFCD08682153
ZINC000009355456
ZINC000009355457

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Available files

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