Vitas-M small molecule compound
4-(6-bromo-5-nitro-1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)benzenesulfonamide
Catalog ID
STL294692
SMILES O=c1n(c2ccc(cc2)S(=O)(=O)N)c(=O)c2c3c1cccc3c(c(c2)[N+](=O)[O-])Br
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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 C18H10BrN3O6S MW 476.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H10BrN3O6S/c19-16-11-2-1-3-12-15(11)13(8-14(16)22(25)26)18(24)21(17(12)23)9-4-6-10(7-5-9)29(20,27)28/h1-8H,(H2,20,27,28)InChIKey
HJUPIBRIMUXTQV-UHFFFAOYSA-NSynonyms
4(6bromo5nitro13dioxo1Hbenzo(de)isoquinolin2(3H)yl)benzenesulfonamide
4(6bromo5nitro13dioxobenzo(de)isoquinolin2yl)benzenesulfonamide
C1=CC2=C3C(=C1)C(=O)N(C(=O)C3=CC(=C2Br)(N+)(=O)(O))C4=CC=C(C=C4)S(=O)(=O)N
InChI=1SC18H10BrN3O6Sc1916112131215(11)13(814(16)22(25)26)18(24)21(17(12)23)94610(759)29(2027)28h18H(H2202728)
MFCD00660047
O=c1n(c2ccc(cc2)S(=O)(=O)N)c(=O)c2c3c1cccc3c(c(c2)(N+)(=O)(O))Br
ZINC000095470780
ZINC95470780
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