Vitas-M small molecule compound
N-(3,4-dimethylphenyl)-4-(6,7-dinitro-1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)benzenesulfonamide
Catalog ID
STL295492
SMILES [O-][N+](=O)c1ccc2c3c1c(ccc3c(=O)n(c2=O)c1ccc(cc1)S(=O)(=O)Nc1ccc(c(c1)C)C)[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 C26H18N4O8S MW 546.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H18N4O8S/c1-14-3-4-16(13-15(14)2)27-39(37,38)18-7-5-17(6-8-18)28-25(31)19-9-11-21(29(33)34)24-22(30(35)36)12-10-20(23(19)24)26(28)32/h3-13,27H,1-2H3InChIKey
ZLHXBNYEJPOLQP-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1ccc2c3c1c(ccc3c(=O)n(c2=O)c1ccc(cc1)S(=O)(=O)Nc1ccc(c(c1)C)C)(N+)(=O)(O)
4(67BISNITRO13DIOXO1HBENZO(DE)ISOQUINOLIN2(3H)YL)N(34DIMETHYLPHENYL)BENZENESULFONAMIDE
CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)N3C(=O)C4=C5C(=CC=C(C5=C(C=C4)(N+)(=O)(O))(N+)(=O)(O))C3=O)C
InChI=1SC26H18N4O8Sc1143416(1315(14)2)2739(3738)187517(6818)2825(31)1991121(29(33)34)2422(30(35)36)121020(23(19)24)26(28)32h31327H12H3
MFCD00659955
N(34dimethylphenyl)4(67dinitro13dioxo1Hbenzo(de)isoquinolin2(3H)yl)benzenesulfonamide
N(34DIMETHYLPHENYL)4(67DINITRO13DIOXOBENZO(DE)ISOQUINOLIN2YL)BENZENESULFONAMIDE
ZINC000002053205
ZINC02053205
ZINC2053205
Check stock
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Check stock on Vitas-MAvailable files
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