Vitas-M small molecule compound

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

Catalog ID
STK282228
SMILES CC(CCN1C(=O)c2c(C1c1c3ccccc3n(c1c1ccccc1)C)cccc2)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 C28H28N2O MW 408.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N2O/c1-19(2)17-18-30-27(21-13-7-8-14-22(21)28(30)31)25-23-15-9-10-16-24(23)29(3)26(25)20-11-5-4-6-12-20/h4-16,19,27H,17-18H2,1-3H3
InChIKey
RGYNGPPRBYXFFX-UHFFFAOYSA-N
Synonyms

2(3methylbutyl)3(1methyl2phenyl1Hindol3yl)23dihydro1Hisoindol1one
2(3METHYLBUTYL)3(1METHYL2PHENYLINDOL3YL)3HISOINDOL1ONE
CC(C)CCN1C(C2=CC=CC=C2C1=O)C3=C(N(C4=CC=CC=C43)C)C5=CC=CC=C5
InChI=1SC28H28N2Oc119(2)17183027(2113781422(21)28(30)31)2523159101624(23)29(3)26(25)20115461220h4161927H1718H213H3
MFCD09270299
ZINC000006023175
ZINC000006023176

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Available files

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