Vitas-M small molecule compound
N-(4-methoxyphenyl)-4-methyl-3-nitro-N-[2-oxo-2-(piperidin-1-yl)ethyl]benzenesulfonamide
Catalog ID
STL123424
SMILES COc1ccc(cc1)N(S(=O)(=O)c1ccc(c(c1)[N+](=O)[O-])C)CC(=O)N1CCCCC1
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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/c1-16-6-11-19(14-20(16)24(26)27)31(28,29)23(17-7-9-18(30-2)10-8-17)15-21(25)22-12-4-3-5-13-22/h6-11,14H,3-5,12-13,15H2,1-2H3InChIKey
CAXWQKZXNVXIBY-UHFFFAOYSA-NSynonyms
CC1=C(C=C(C=C1)S(=O)(=O)N(CC(=O)N2CCCCC2)C3=CC=C(C=C3)OC)(N+)(=O)(O)
COc1ccc(cc1)N(S(=O)(=O)c1ccc(c(c1)(N+)(=O)(O))C)CC(=O)N1CCCCC1
InChI=1SC21H25N3O6Sc11661119(1420(16)24(26)27)31(2829)23(177918(302)10817)1521(25)22124351322h61114H35121315H212H3
MFCD02576446
N(4methoxyphenyl)4methyl3nitroN(2oxo2(piperidin1yl)ethyl)benzenesulfonamide
N(4METHOXYPHENYL)4METHYL3NITRON(2OXO2PIPERIDIN1YLETHYL)BENZENESULFONAMIDE
ZINC000013402718
ZINC13402718
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