Vitas-M small molecule compound
2-chloro-5-[(6-cyano-1,3-benzodioxol-5-yl)sulfamoyl]-N-(4-nitrophenyl)benzamide
Catalog ID
STK773932
SMILES N#Cc1cc2OCOc2cc1NS(=O)(=O)c1ccc(c(c1)C(=O)Nc1ccc(cc1)[N+](=O)[O-])Cl
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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 C21H13ClN4O7S MW 500.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H13ClN4O7S/c22-17-6-5-15(8-16(17)21(27)24-13-1-3-14(4-2-13)26(28)29)34(30,31)25-18-9-20-19(32-11-33-20)7-12(18)10-23/h1-9,25H,11H2,(H,24,27)InChIKey
KNFRZBJVLLHEBM-UHFFFAOYSA-NSynonyms
2chloro5((6cyano13benzodioxol5yl)sulfamoyl)N(4nitrophenyl)benzamide
C1OC2=C(O1)C=C(C(=C2)C#N)NS(=O)(=O)C3=CC(=C(C=C3)Cl)C(=O)NC4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC21H13ClN4O7Sc22176515(816(17)21(27)24131314(4213)26(28)29)34(3031)251892019(32113320)712(18)1023h1925H11H2(H2427)
MFCD03855862
N#Cc1cc2OCOc2cc1NS(=O)(=O)c1ccc(c(c1)C(=O)Nc1ccc(cc1)(N+)(=O)(O))Cl
ZINC000008892150
ZINC08892150
ZINC8892150
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