Vitas-M small molecule compound

N-(2,4-dimethylphenyl)-1-[(4-nitro-1H-pyrazol-1-yl)methyl]-1H-pyrazole-3-carboxamide

Catalog ID
STL401943
SMILES Cc1ccc(c(c1)C)NC(=O)c1ccn(n1)Cn1ncc(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 C16H16N6O3 MW 340.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N6O3/c1-11-3-4-14(12(2)7-11)18-16(23)15-5-6-20(19-15)10-21-9-13(8-17-21)22(24)25/h3-9H,10H2,1-2H3,(H,18,23)
InChIKey
PIILIETWRNFMMS-UHFFFAOYSA-N
Synonyms
1005637-05-7
1005637057
CC1=CC(=C(C=C1)NC(=O)C2=NN(C=C2)CN3C=C(C=N3)(N+)(=O)(O))C
Cc1ccc(c(c1)C)NC(=O)c1ccn(n1)Cn1ncc(c1)(N+)(=O)(O)
InChI=1SC16H16N6O3c1113414(12(2)711)1816(23)155620(1915)1021913(81721)22(24)25h39H10H212H3(H1823)
MFCD04046275
N(24dimethylphenyl)1((4nitro1Hpyrazol1yl)methyl)1Hpyrazole3carboxamide
N(24DIMETHYLPHENYL)1((4NITROPYRAZOL1YL)METHYL)PYRAZOLE3CARBOXAMIDE
ZINC000002788398
ZINC02788398
ZINC2788398

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Available files

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