Vitas-M small molecule compound
4-chloro-N-{4-[(2,6-dimethylphenyl)sulfamoyl]phenyl}-3-nitrobenzamide
Catalog ID
STK327606
SMILES O=C(c1ccc(c(c1)[N+](=O)[O-])Cl)Nc1ccc(cc1)S(=O)(=O)Nc1c(C)cccc1C
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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 C21H18ClN3O5S MW 459.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClN3O5S/c1-13-4-3-5-14(2)20(13)24-31(29,30)17-9-7-16(8-10-17)23-21(26)15-6-11-18(22)19(12-15)25(27)28/h3-12,24H,1-2H3,(H,23,26)InChIKey
FYVREVGMPQTGQB-UHFFFAOYSA-NSynonyms
4CHLORON(4(((26DIMETHYLPHENYL)AMINO)SULFONYL)PHENYL)3NITROBENZAMIDE
4CHLORON(4((26DIMETHYLPHENYL)SULFAMOYL)PHENYL)3NITROBENZAMIDE
CC1=C(C(=CC=C1)C)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3)Cl)(N+)(=O)(O)
InChI=1SC21H18ClN3O5Sc11343514(2)20(13)2431(2930)179716(81017)2321(26)1561118(22)19(1215)25(27)28h31224H12H3(H2326)
MFCD03704980
O=C(c1ccc(c(c1)(N+)(=O)(O))Cl)Nc1ccc(cc1)S(=O)(=O)Nc1c(C)cccc1C
ZINC000001165999
ZINC01165999
ZINC1165999
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