Vitas-M small molecule compound
{1-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-1H-pyrazol-3-yl}[5-hydroxy-3-methyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]methanone
Catalog ID
STL401282
SMILES CC1=NN(C(C1)(O)C(F)(F)F)C(=O)c1ccn(n1)Cn1nc(c(c1C)[N+](=O)[O-])C
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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 C15H16F3N7O4 MW 415.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16F3N7O4/c1-8-6-14(27,15(16,17)18)24(19-8)13(26)11-4-5-22(21-11)7-23-10(3)12(25(28)29)9(2)20-23/h4-5,27H,6-7H2,1-3H3InChIKey
LJJHBJLZSIOGJR-UHFFFAOYSA-NSynonyms
1005585-04-5(1((35dimethyl4nitro1Hpyrazol1yl)methyl)1Hpyrazol3yl)(5hydroxy3methyl5(trifluoromethyl)45dihydro1Hpyrazol1yl)methanone
(1((35dimethyl4nitropyrazol1yl)methyl)pyrazol3yl)(5hydroxy3methyl5(trifluoromethyl)4Hpyrazol1yl)methanone
1005585045
CC1=NN(C(C1)(C(F)(F)F)O)C(=O)C2=NN(C=C2)CN3C(=C(C(=N3)C)(N+)(=O)(O))C
CC1=NN(C(C1)(O)C(F)(F)F)C(=O)c1ccn(n1)Cn1nc(c(c1C)(N+)(=O)(O))C
InChI=1SC15H16F3N7O4c18614(2715(1617)18)24(198)13(26)114522(2111)72310(3)12(25(28)29)9(2)2023h4527H67H213H3
MFCD04129751
ZINC000017090236
ZINC000017090237
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