Vitas-M small molecule compound
2-{[(E)-(3-bromo-4,5-dimethoxyphenyl)methylidene]amino}-3a,4,7,7a-tetrahydro-1H-4,7-ethanoisoindole-1,3(2H)-dione
Catalog ID
STK280779
SMILES COc1c(Br)cc(cc1OC)/C=N/N1C(=O)C2C(C1=O)C1CCC2C=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 C19H19BrN2O4 MW 419.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19BrN2O4/c1-25-14-8-10(7-13(20)17(14)26-2)9-21-22-18(23)15-11-3-4-12(6-5-11)16(15)19(22)24/h3-4,7-9,11-12,15-16H,5-6H2,1-2H3/b21-9+InChIKey
WVPXDLOYWIDJSQ-ZVBGSRNCSA-NSynonyms
2(((E)(3bromo45dimethoxyphenyl)methylidene)amino)3a477atetrahydro1H47ethanoisoindole13(2H)dione
COC1=C(C(=CC(=C1)C=NN2C(=O)C3C4CCC(C3C2=O)C=C4)Br)OC
COc1c(Br)cc(cc1OC)C=NN1C(=O)C2C(C1=O)C1CCC2C=C1
InChI=1SC19H19BrN2O4c12514810(713(20)17(14)262)9212218(23)15113412(6511)16(15)19(22)24h347911121516H56H212H3b219+
MFCD01173619
ZINC000100182443
ZINC000105214919
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