Vitas-M small molecule compound
4-(5,8-dinitro-1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)-N,N-diethylbenzenesulfonamide
Catalog ID
STK750934
SMILES CCN(S(=O)(=O)c1ccc(cc1)n1c(=O)c2cc(cc3c2c(c1=O)cc(c3)[N+](=O)[O-])[N+](=O)[O-])CC
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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 C22H18N4O8S MW 498.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18N4O8S/c1-3-23(4-2)35(33,34)17-7-5-14(6-8-17)24-21(27)18-11-15(25(29)30)9-13-10-16(26(31)32)12-19(20(13)18)22(24)28/h5-12H,3-4H2,1-2H3InChIKey
DYJOGQLSIXGPBX-UHFFFAOYSA-NSynonyms
4(58dinitro13dioxo1Hbenzo(de)isoquinolin2(3H)yl)NNdiethylbenzenesulfonamide
4(58DINITRO13DIOXOBENZO(DE)ISOQUINOLIN2YL)NNDIETHYLBENZENESULFONAMIDE
CCN(CC)S(=O)(=O)C1=CC=C(C=C1)N2C(=O)C3=CC(=CC4=CC(=CC(=C43)C2=O)(N+)(=O)(O))(N+)(=O)(O)
CCN(S(=O)(=O)c1ccc(cc1)n1c(=O)c2cc(cc3c2c(c1=O)cc(c3)(N+)(=O)(O))(N+)(=O)(O))CC
InChI=1SC22H18N4O8Sc1323(42)35(3334)177514(6817)2421(27)181115(25(29)30)9131016(26(31)32)1219(20(13)18)22(24)28h512H34H212H3
MFCD00659999
ZINC000003044958
ZINC03044958
ZINC3044958
Check stock
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Check stock on Vitas-MAvailable files
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