Vitas-M small molecule compound

2-{[(2,5-dimethylphenyl)amino]methyl}-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione

Catalog ID
STK268332
SMILES O=C1C2C3C=CC(C2C(=O)N1CNc1cc(C)ccc1C)C3

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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 C18H20N2O2 MW 296.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N2O2/c1-10-3-4-11(2)14(7-10)19-9-20-17(21)15-12-5-6-13(8-12)16(15)18(20)22/h3-7,12-13,15-16,19H,8-9H2,1-2H3
InChIKey
YLJDBQDWOQWHCJ-UHFFFAOYSA-N
Synonyms

2(((25dimethylphenyl)amino)methyl)3a477atetrahydro1H47methanoisoindole13(2H)dione
CC1=CC(=C(C=C1)C)NCN2C(=O)C3C4CC(C3C2=O)C=C4
InChI=1SC18H20N2O2c1103411(2)14(710)1992017(21)15125613(812)16(15)18(20)22h371213151619H89H212H3
MFCD01138185
ZINC000100537653
ZINC000239254593

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Available files

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