Vitas-M small molecule compound
3-[1'-ethyl-3',5'-dimethyl-2-(4-nitrophenyl)-3,4-dihydro-1'H,2H-3,4'-bipyrazol-5-yl]phenol
Catalog ID
STL181746
SMILES CCn1nc(c(c1C)C1CC(=NN1c1ccc(cc1)[N+](=O)[O-])c1cccc(c1)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 C22H23N5O3 MW 405.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N5O3/c1-4-25-15(3)22(14(2)23-25)21-13-20(16-6-5-7-19(28)12-16)24-26(21)17-8-10-18(11-9-17)27(29)30/h5-12,21,28H,4,13H2,1-3H3InChIKey
YGGKRFWTAWVTHV-UHFFFAOYSA-NSynonyms
1263035-50-21263035502
3(1ethyl35dimethyl2(4nitrophenyl)34dihydro1H2H34bipyrazol5yl)phenol
3(3(1ethyl35dimethylpyrazol4yl)2(4nitrophenyl)34dihydropyrazol5yl)phenol
3(5(1ETHYL35DIMETHYLPYRAZOL4YL)1(4NITROPHENYL)2PYRAZOLIN3YL)PHENOL
CCN1C(=C(C(=N1)C)C2CC(=NN2C3=CC=C(C=C3)(N+)(=O)(O))C4=CC(=CC=C4)O)C
CCn1nc(c(c1C)C1CC(=NN1c1ccc(cc1)(N+)(=O)(O))c1cccc(c1)O)C
InChI=1SC22H23N5O3c142515(3)22(14(2)2325)211320(1665719(28)1216)2426(21)1781018(11917)27(29)30h5122128H413H213H3
MFCD20760120
ZINC000071785129
ZINC000071785130
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