Vitas-M small molecule compound

N-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]-3-nitrobenzamide

Catalog ID
STK425254
SMILES CCn1ncc(c1C)CNC(=O)c1cccc(c1)[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 C14H16N4O3 MW 288.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H16N4O3/c1-3-17-10(2)12(9-16-17)8-15-14(19)11-5-4-6-13(7-11)18(20)21/h4-7,9H,3,8H2,1-2H3,(H,15,19)
InChIKey
LMIOMFWJIOQBOQ-UHFFFAOYSA-N
Synonyms

CCN1C(=C(C=N1)CNC(=O)C2=CC(=CC=C2)(N+)(=O)(O))C
CCn1ncc(c1C)CNC(=O)c1cccc(c1)(N+)(=O)(O)
InChI=1SC14H16N4O3c131710(2)12(91617)81514(19)1154613(711)18(20)21h479H38H212H3(H1519)
MFCD02375313
N((1ethyl5methyl1Hpyrazol4yl)methyl)3nitrobenzamide
N((1ETHYL5METHYLPYRAZOL4YL)METHYL)(3NITROPHENYL)CARBOXAMIDE
N((1ETHYL5METHYLPYRAZOL4YL)METHYL)3NITROBENZAMIDE
ZINC000000473354
ZINC00473354
ZINC473354

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Available files

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