Vitas-M small molecule compound
N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-N-(2-methoxy-5-nitrophenyl)methanesulfonamide
Catalog ID
STL114416
SMILES COc1ccc(cc1N(S(=O)(=O)C)CC(=O)N1CCc2c(C1)cccc2)[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 C19H21N3O6S MW 419.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21N3O6S/c1-28-18-8-7-16(22(24)25)11-17(18)21(29(2,26)27)13-19(23)20-10-9-14-5-3-4-6-15(14)12-20/h3-8,11H,9-10,12-13H2,1-2H3InChIKey
ILYSSFJFMMTXHY-UHFFFAOYSA-NSynonyms
COC1=C(C=C(C=C1)(N+)(=O)(O))N(CC(=O)N2CCC3=CC=CC=C3C2)S(=O)(=O)C
COc1ccc(cc1N(S(=O)(=O)C)CC(=O)N1CCc2c(C1)cccc2)(N+)(=O)(O)
InChI=1SC19H21N3O6Sc128188716(22(24)25)1117(18)21(29(226)27)1319(23)2010914534615(14)1220h3811H9101213H212H3
MFCD05836875
N(2(34DIHYDRO1HISOQUINOLIN2YL)2OXOETHYL)N(2METHOXY5NITROPHENYL)METHANESULFONAMIDE
N(2(34dihydroisoquinolin2(1H)yl)2oxoethyl)N(2methoxy5nitrophenyl)methanesulfonamide
ZINC000002875677
ZINC02875677
ZINC2875677
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