Vitas-M small molecule compound

N-cyclohexyl-N-methyl-5-(4-nitrophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide

Catalog ID
STK343027
SMILES CN(C(=O)c1nn2c(c1)nc(cc2C(F)(F)F)c1ccc(cc1)[N+](=O)[O-])C1CCCCC1

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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 C21H20F3N5O3 MW 447.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20F3N5O3/c1-27(14-5-3-2-4-6-14)20(30)17-12-19-25-16(11-18(21(22,23)24)28(19)26-17)13-7-9-15(10-8-13)29(31)32/h7-12,14H,2-6H2,1H3
InChIKey
ODJMXMMZICYQJP-UHFFFAOYSA-N
Synonyms
333765-31-4
333765314
CN(C(=O)c1nn2c(c1)nc(cc2C(F)(F)F)c1ccc(cc1)(N+)(=O)(O))C1CCCCC1
CN(C1CCCCC1)C(=O)C2=NN3C(=CC(=NC3=C2)C4=CC=C(C=C4)(N+)(=O)(O))C(F)(F)F
InChI=1SC21H20F3N5O3c127(145324614)20(30)1712192516(1118(21(2223)24)28(19)2617)137915(10813)29(31)32h71214H26H21H3
MFCD01445160
NCYCLOHEXYLNMETHYL(5(4NITROPHENYL)7(TRIFLUOROMETHYL)(8HYDROPYRAZOLO(15A)PYRIMIDIN2YL))CARBOXAMIDE
NCYCLOHEXYLNMETHYL5(4NITROPHENYL)7(TRIFLUOROMETHYL)PYRAZOLO(15A)PYRIMIDINE2CARBOXAMIDE
ZINC000000845323
ZINC00845323
ZINC845323

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Available files

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