Vitas-M small molecule compound
2-{[(4-bromo-3,5-dimethylphenyl)amino]methyl}hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione
Catalog ID
STK253419
SMILES O=C1C2C3C=CC(C2C(=O)N1CNc1cc(C)c(c(c1)C)Br)C1C3C1
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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 C20H21BrN2O2 MW 401.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21BrN2O2/c1-9-5-11(6-10(2)18(9)21)22-8-23-19(24)16-12-3-4-13(15-7-14(12)15)17(16)20(23)25/h3-6,12-17,22H,7-8H2,1-2H3InChIKey
ADAGSCDZPVUSQZ-UHFFFAOYSA-NSynonyms
1005035-22-21005035222
2(((4bromo35dimethylphenyl)amino)methyl)hexahydro46ethenocyclopropa(f)isoindole13(2H3aH)dione
CC1=CC(=CC(=C1Br)C)NCN2C(=O)C3C4C=CC(C3C2=O)C5C4C5
InChI=1SC20H21BrN2O2c19511(610(2)18(9)21)2282319(24)16123413(15714(12)15)17(16)20(23)25h36121722H78H212H3
MFCD03274164
ZINC000238997261
ZINC000238997268
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