Vitas-M small molecule compound

N-(3,5-dimethylphenyl)-4-nitro-1H-pyrazole-3-carboxamide

Catalog ID
STK960375
SMILES Cc1cc(cc(c1)C)NC(=O)c1n[nH]cc1[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 C12H12N4O3 MW 260.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12N4O3/c1-7-3-8(2)5-9(4-7)14-12(17)11-10(16(18)19)6-13-15-11/h3-6H,1-2H3,(H,13,15)(H,14,17)
InChIKey
BWXODSRSWFQBJS-UHFFFAOYSA-N
Synonyms
515174-89-7
515174897
CC1=CC(=CC(=C1)NC(=O)C2=C(C=NN2)(N+)(=O)(O))C
Cc1cc(cc(c1)C)NC(=O)c1n(nH)cc1(N+)(=O)(O)
InChI=1SC12H12N4O3c1738(2)59(47)1412(17)1110(16(18)19)6131511h36H12H3(H1315)(H1417)
MFCD03072348
N(35DIMETHYLPHENYL)(4NITROPYRAZOL3YL)CARBOXAMIDE
N(35dimethylphenyl)4nitro1Hpyrazole3carboxamide
N(35dimethylphenyl)4nitro1Hpyrazole5carboxamide
ZINC000005490428
ZINC05490428
ZINC5490428

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Available files

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