Vitas-M small molecule compound
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N~2~-(2-methoxy-5-nitrophenyl)-N~2~-(methylsulfonyl)glycinamide
Catalog ID
STK357573
SMILES COc1ccc(cc1N(S(=O)(=O)C)CC(=O)Nc1ccc2c(c1)OCCO2)[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 C18H19N3O8S MW 437.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N3O8S/c1-27-15-6-4-13(21(23)24)10-14(15)20(30(2,25)26)11-18(22)19-12-3-5-16-17(9-12)29-8-7-28-16/h3-6,9-10H,7-8,11H2,1-2H3,(H,19,22)InChIKey
TVGQHPCHCGSNAY-UHFFFAOYSA-NSynonyms
COC1=C(C=C(C=C1)(N+)(=O)(O))N(CC(=O)NC2=CC3=C(C=C2)OCCO3)S(=O)(=O)C
COc1ccc(cc1N(S(=O)(=O)C)CC(=O)Nc1ccc2c(c1)OCCO2)(N+)(=O)(O)
InChI=1SC18H19N3O8Sc127156413(21(23)24)1014(15)20(30(225)26)1118(22)1912351617(912)29872816h36910H7811H212H3(H1922)
MFCD06623692
N(23DIHYDRO14BENZODIOXIN6YL)2(2METHOXYNMETHYLSULFONYL5NITROANILINO)ACETAMIDE
N(23dihydro14benzodioxin6yl)N~2~(2methoxy5nitrophenyl)N~2~(methylsulfonyl)glycinamide
N(23DIHYDRO14BENZODIOXIN6YL)N2(2METHOXY5NITROPHENYL)N2(METHYLSULFONYL)GLYCINAMIDE
ZINC000016226969
ZINC16226969
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