Vitas-M small molecule compound
6-bromo-2-[(4-methylphenyl)amino]-5-nitro-1H-benzo[de]isoquinoline-1,3(2H)-dione
Catalog ID
STL294654
SMILES Cc1ccc(cc1)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 C19H12BrN3O4 MW 426.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H12BrN3O4/c1-10-5-7-11(8-6-10)21-22-18(24)13-4-2-3-12-16(13)14(19(22)25)9-15(17(12)20)23(26)27/h2-9,21H,1H3InChIKey
XENKGXXINNKHMU-UHFFFAOYSA-NSynonyms
6bromo2((4methylphenyl)amino)5nitro1Hbenzo(de)isoquinoline13(2H)dione
6bromo2(4methylanilino)5nitrobenzo(de)isoquinoline13dione
CC1=CC=C(C=C1)NN2C(=O)C3=CC=CC4=C3C(=CC(=C4Br)(N+)(=O)(O))C2=O
Cc1ccc(cc1)Nn1c(=O)c2cccc3c2c(c1=O)cc(c3Br)(N+)(=O)(O)
InChI=1SC19H12BrN3O4c1105711(8610)212218(24)134231216(13)14(19(22)25)915(17(12)20)23(26)27h2921H1H3
MFCD00660036
ZINC000095470754
ZINC95470754
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