Vitas-M small molecule compound
6-bromo-2-[(2,4-dimethylphenyl)amino]-5-nitro-1H-benzo[de]isoquinoline-1,3(2H)-dione
Catalog ID
STL294655
SMILES Cc1ccc(c(c1)C)Nn1c(=O)c2cccc3c2c(c1=O)cc(c3Br)[N+](=O)[O-]
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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 C20H14BrN3O4 MW 440.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14BrN3O4/c1-10-6-7-15(11(2)8-10)22-23-19(25)13-5-3-4-12-17(13)14(20(23)26)9-16(18(12)21)24(27)28/h3-9,22H,1-2H3InChIKey
UQCJSDMNWIPGBR-UHFFFAOYSA-NSynonyms
6bromo2((24dimethylphenyl)amino)5nitro1Hbenzo(de)isoquinoline13(2H)dione
6bromo2(24dimethylanilino)5nitrobenzo(de)isoquinoline13dione
CC1=CC(=C(C=C1)NN2C(=O)C3=CC=CC4=C3C(=CC(=C4Br)(N+)(=O)(O))C2=O)C
Cc1ccc(c(c1)C)Nn1c(=O)c2cccc3c2c(c1=O)cc(c3Br)(N+)(=O)(O)
InChI=1SC20H14BrN3O4c1106715(11(2)810)222319(25)135341217(13)14(20(23)26)916(18(12)21)24(27)28h3922H12H3
MFCD00660038
ZINC000095470755
ZINC95470755
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