Vitas-M small molecule compound

N-(4-chloro-2,5-dimethoxyphenyl)-N~2~-(2-methoxy-5-nitrophenyl)-N~2~-(methylsulfonyl)glycinamide

Catalog ID
STK264066
SMILES COc1cc(Cl)c(cc1NC(=O)CN(S(=O)(=O)C)c1cc(ccc1OC)[N+](=O)[O-])OC

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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 C18H20ClN3O8S MW 473.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20ClN3O8S/c1-28-15-6-5-11(22(24)25)7-14(15)21(31(4,26)27)10-18(23)20-13-9-16(29-2)12(19)8-17(13)30-3/h5-9H,10H2,1-4H3,(H,20,23)
InChIKey
YCRILBMVTIBIOF-UHFFFAOYSA-N
Synonyms

COC1=C(C=C(C=C1)(N+)(=O)(O))N(CC(=O)NC2=CC(=C(C=C2OC)Cl)OC)S(=O)(=O)C
COc1cc(Cl)c(cc1NC(=O)CN(S(=O)(=O)C)c1cc(ccc1OC)(N+)(=O)(O))OC
InChI=1SC18H20ClN3O8Sc128156511(22(24)25)714(15)21(31(426)27)1018(23)2013916(292)12(19)817(13)303h59H10H214H3(H2023)
MFCD08672423
N(4chloro25dimethoxyphenyl)2(2methoxyNmethylsulfonyl5nitroanilino)acetamide
N(4chloro25dimethoxyphenyl)N~2~(2methoxy5nitrophenyl)N~2~(methylsulfonyl)glycinamide
N(4CHLORO25DIMETHOXYPHENYL)N2(2METHOXY5NITROPHENYL)N2(METHYLSULFONYL)GLYCINAMIDE
ZINC000009489310
ZINC09489310
ZINC9489310

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.