Vitas-M small molecule compound
N-{3,5-dimethyl-1-[3-(trifluoromethyl)benzyl]-1H-pyrazol-4-yl}-4-nitrobenzamide
Catalog ID
STK308381
SMILES O=C(c1ccc(cc1)[N+](=O)[O-])Nc1c(C)nn(c1C)Cc1cccc(c1)C(F)(F)F
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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 C20H17F3N4O3 MW 418.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17F3N4O3/c1-12-18(24-19(28)15-6-8-17(9-7-15)27(29)30)13(2)26(25-12)11-14-4-3-5-16(10-14)20(21,22)23/h3-10H,11H2,1-2H3,(H,24,28)InChIKey
DBJWOBWJCCPYPW-UHFFFAOYSA-NSynonyms
1005599-05-21005599052
CC1=C(C(=NN1CC2=CC(=CC=C2)C(F)(F)F)C)NC(=O)C3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC20H17F3N4O3c11218(2419(28)156817(9715)27(29)30)13(2)26(2512)111443516(1014)20(2122)23h310H11H212H3(H2428)
MFCD04132167
N(35DIMETHYL1((3(TRIFLUOROMETHYL)PHENYL)METHYL)PYRAZOL4YL)4NITROBENZAMIDE
N(35dimethyl1(3(trifluoromethyl)benzyl)1Hpyrazol4yl)4nitrobenzamide
O=C(c1ccc(cc1)(N+)(=O)(O))Nc1c(C)nn(c1C)Cc1cccc(c1)C(F)(F)F
ZINC000002796515
ZINC02796515
ZINC2796515
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