Vitas-M small molecule compound
N-[3,5-dimethyl-1-(2-methylbenzyl)-1H-pyrazol-4-yl]-4-nitrobenzamide
Catalog ID
STK316793
SMILES O=C(c1ccc(cc1)[N+](=O)[O-])Nc1c(C)nn(c1C)Cc1ccccc1C
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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 C20H20N4O3 MW 364.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4O3/c1-13-6-4-5-7-17(13)12-23-15(3)19(14(2)22-23)21-20(25)16-8-10-18(11-9-16)24(26)27/h4-11H,12H2,1-3H3,(H,21,25)InChIKey
GBGXDFSLAFCBPQ-UHFFFAOYSA-NSynonyms
492422-38-5492422385
CC1=CC=CC=C1CN2C(=C(C(=N2)C)NC(=O)C3=CC=C(C=C3)(N+)(=O)(O))C
InChI=1SC20H20N4O3c113645717(13)122315(3)19(14(2)2223)2120(25)1681018(11916)24(26)27h411H12H213H3(H2125)
MFCD03072595
N(35DIMETHYL1((2METHYLPHENYL)METHYL)PYRAZOL4YL)4NITROBENZAMIDE
N(35dimethyl1(2methylbenzyl)1Hpyrazol4yl)4nitrobenzamide
O=C(c1ccc(cc1)(N+)(=O)(O))Nc1c(C)nn(c1C)Cc1ccccc1C
ZINC000002763378
ZINC02763378
ZINC2763378
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