Vitas-M small molecule compound

1-benzyl-1-ethyl-3-(2-methyl-4-nitrophenyl)urea

Catalog ID
STK474065
SMILES CCN(C(=O)Nc1ccc(cc1C)[N+](=O)[O-])Cc1ccccc1

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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 C17H19N3O3 MW 313.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19N3O3/c1-3-19(12-14-7-5-4-6-8-14)17(21)18-16-10-9-15(20(22)23)11-13(16)2/h4-11H,3,12H2,1-2H3,(H,18,21)
InChIKey
STXDSSYXMURMSC-UHFFFAOYSA-N
Synonyms

(ETHYLBENZYLAMINO)N(2METHYL4NITROPHENYL)CARBOXAMIDE
1benzyl1ethyl3(2methyl4nitrophenyl)urea
CCN(C(=O)Nc1ccc(cc1C)(N+)(=O)(O))Cc1ccccc1
CCN(CC1=CC=CC=C1)C(=O)NC2=C(C=C(C=C2)(N+)(=O)(O))C
InChI=1SC17H19N3O3c1319(12147546814)17(21)181610915(20(22)23)1113(16)2h411H312H212H3(H1821)
MFCD07612704
ZINC000017052388
ZINC17052388

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Available files

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