Vitas-M small molecule compound
3-[2-(4-nitrophenyl)-1'-propyl-3,4-dihydro-1'H,2H-3,4'-bipyrazol-5-yl]phenol
Catalog ID
STL181765
SMILES CCCn1ncc(c1)C1CC(=NN1c1ccc(cc1)[N+](=O)[O-])c1cccc(c1)O
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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 C21H21N5O3 MW 391.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5O3/c1-2-10-24-14-16(13-22-24)21-12-20(15-4-3-5-19(27)11-15)23-25(21)17-6-8-18(9-7-17)26(28)29/h3-9,11,13-14,21,27H,2,10,12H2,1H3InChIKey
KURAHJYSMCTERH-UHFFFAOYSA-NSynonyms
1263035-26-21263035262
3(1(4NITROPHENYL)5(1PROPYLPYRAZOL4YL)2PYRAZOLIN3YL)PHENOL
3(2(4nitrophenyl)1propyl34dihydro1H2H34bipyrazol5yl)phenol
3(2(4nitrophenyl)3(1propylpyrazol4yl)34dihydropyrazol5yl)phenol
CCCN1C=C(C=N1)C2CC(=NN2C3=CC=C(C=C3)(N+)(=O)(O))C4=CC(=CC=C4)O
CCCn1ncc(c1)C1CC(=NN1c1ccc(cc1)(N+)(=O)(O))c1cccc(c1)O
InChI=1SC21H21N5O3c1210241416(132224)211220(1543519(27)1115)2325(21)176818(9717)26(28)29h391113142127H21012H21H3
MFCD20760138
ZINC000071785156
ZINC000071785157
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