Vitas-M small molecule compound
3-[1'-ethyl-5'-methyl-2-(4-nitrophenyl)-3,4-dihydro-1'H,2H-3,4'-bipyrazol-5-yl]phenol
Catalog ID
STL181744
SMILES CCn1ncc(c1C)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/c1-3-24-14(2)19(13-22-24)21-12-20(15-5-4-6-18(27)11-15)23-25(21)16-7-9-17(10-8-16)26(28)29/h4-11,13,21,27H,3,12H2,1-2H3InChIKey
UELPIRRKLQDQNC-UHFFFAOYSA-NSynonyms
1263035-35-31263035353
3(1ethyl5methyl2(4nitrophenyl)34dihydro1H2H34bipyrazol5yl)phenol
3(3(1ethyl5methylpyrazol4yl)2(4nitrophenyl)34dihydropyrazol5yl)phenol
3(5(1ETHYL5METHYLPYRAZOL4YL)1(4NITROPHENYL)2PYRAZOLIN3YL)PHENOL
CCN1C(=C(C=N1)C2CC(=NN2C3=CC=C(C=C3)(N+)(=O)(O))C4=CC(=CC=C4)O)C
CCn1ncc(c1C)C1CC(=NN1c1ccc(cc1)(N+)(=O)(O))c1cccc(c1)O
InChI=1SC21H21N5O3c132414(2)19(132224)211220(1554618(27)1115)2325(21)167917(10816)26(28)29h411132127H312H212H3
MFCD20760118
ZINC000071785125
ZINC000071785126
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