Vitas-M small molecule compound

2-[1,3-dioxo-8-(propan-2-ylidene)-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl]benzonitrile

Catalog ID
STK258087
SMILES N#Cc1ccccc1N1C(=O)C2C(C1=O)C1C(=C(C)C)C2C=C1

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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 C19H16N2O2 MW 304.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16N2O2/c1-10(2)15-12-7-8-13(15)17-16(12)18(22)21(19(17)23)14-6-4-3-5-11(14)9-20/h3-8,12-13,16-17H,1-2H3
InChIKey
IQRRMJBELVGXQL-UHFFFAOYSA-N
Synonyms

2(13dioxo8(propan2ylidene)133a477ahexahydro2H47methanoisoindol2yl)benzonitrile
CC(=C1C2C=CC1C3C2C(=O)N(C3=O)C4=CC=CC=C4C#N)C
InChI=1SC19H16N2O2c110(2)15127813(15)1716(12)18(22)21(19(17)23)14643511(14)920h3812131617H12H3
MFCD01802276
ZINC000100079201
ZINC000245226695

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Available files

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