Vitas-M small molecule compound
3-(azepan-1-ylcarbonyl)-4-methoxy-N-(2-methyl-3-nitrophenyl)benzenesulfonamide
Catalog ID
STK264104
SMILES COc1ccc(cc1C(=O)N1CCCCCC1)S(=O)(=O)Nc1cccc(c1C)[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 C21H25N3O6S MW 447.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N3O6S/c1-15-18(8-7-9-19(15)24(26)27)22-31(28,29)16-10-11-20(30-2)17(14-16)21(25)23-12-5-3-4-6-13-23/h7-11,14,22H,3-6,12-13H2,1-2H3InChIKey
QMJOQUZWQJYZHU-UHFFFAOYSA-NSynonyms
3(azepan1ylcarbonyl)4methoxyN(2methyl3nitrophenyl)benzenesulfonamide
3(azepane1carbonyl)4methoxyN(2methyl3nitrophenyl)benzenesulfonamide
CC1=C(C=CC=C1(N+)(=O)(O))NS(=O)(=O)C2=CC(=C(C=C2)OC)C(=O)N3CCCCCC3
COc1ccc(cc1C(=O)N1CCCCCC1)S(=O)(=O)Nc1cccc(c1C)(N+)(=O)(O)
InChI=1SC21H25N3O6Sc11518(87919(15)24(26)27)2231(2829)16101120(302)17(1416)21(25)231253461323h7111422H361213H212H3
MFCD08684354
ZINC000009356544
ZINC09356544
ZINC9356544
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