Vitas-M small molecule compound
2-methyl-N-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]-3-(4-nitro-1H-pyrazol-1-yl)propanamide
Catalog ID
STL402667
SMILES O=C(C(Cn1ncc(c1)[N+](=O)[O-])C)Nc1c(C)[nH]nc1C(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 C12H13F3N6O3 MW 346.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13F3N6O3/c1-6(4-20-5-8(3-16-20)21(23)24)11(22)17-9-7(2)18-19-10(9)12(13,14)15/h3,5-6H,4H2,1-2H3,(H,17,22)(H,18,19)InChIKey
QNZORZHIXAIFTI-UHFFFAOYSA-NSynonyms
1092791-85-91092791859
2methylN(5methyl3(trifluoromethyl)1Hpyrazol4yl)3(4nitro1Hpyrazol1yl)propanamide
2methylN(5methyl3(trifluoromethyl)1Hpyrazol4yl)3(4nitropyrazol1yl)propanamide
CC1=C(C(=NN1)C(F)(F)F)NC(=O)C(C)CN2C=C(C=N2)(N+)(=O)(O)
InChI=1SC12H13F3N6O3c16(42058(31620)21(23)24)11(22)1797(2)181910(9)12(1314)15h356H4H212H3(H1722)(H1819)
MFCD04135722
O=C(C(Cn1ncc(c1)(N+)(=O)(O))C)Nc1c(C)(nH)nc1C(F)(F)F
ZINC000006412496
ZINC000006412502
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