Vitas-M small molecule compound
5-({4-[(1Z)-1-{2-[2-methyl-3-(4-nitro-1H-pyrazol-1-yl)propanoyl]hydrazinylidene}ethyl]phenoxy}methyl)furan-2-carboxylic acid
Catalog ID
STK308106
SMILES O=C(C(Cn1ncc(c1)[N+](=O)[O-])C)N/N=C(\c1ccc(cc1)OCc1ccc(o1)C(=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 C21H21N5O7 MW 455.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5O7/c1-13(10-25-11-16(9-22-25)26(30)31)20(27)24-23-14(2)15-3-5-17(6-4-15)32-12-18-7-8-19(33-18)21(28)29/h3-9,11,13H,10,12H2,1-2H3,(H,24,27)(H,28,29)/b23-14-InChIKey
WEBWPWIYVLOAAO-UCQKPKSFSA-NSynonyms
1005594-12-61005594126
5((4((1Z)1(2(2methyl3(4nitro1Hpyrazol1yl)propanoyl)hydrazinylidene)ethyl)phenoxy)methyl)furan2carboxylicacid
5((4((1Z)1METHYL2(2METHYL3(4NITROPYRAZOLYL)PROPANOYLAMINO)2AZAVINYL)PHENOXY)METHYL)FURAN2CARBOXYLICACID
5((4((Z)CMETHYLN((2METHYL3(4NITROPYRAZOL1YL)PROPANOYL)AMINO)CARBONIMIDOYL)PHENOXY)METHYL)FURAN2CARBOXYLICACID
CC(CN1C=C(C=N1)(N+)(=O)(O))C(=O)NN=C(C)C2=CC=C(C=C2)OCC3=CC=C(O3)C(=O)O
InChI=1SC21H21N5O7c113(10251116(92225)26(30)31)20(27)242314(2)153517(6415)3212187819(3318)21(28)29h391113H1012H212H3(H2427)(H2829)b2314
MFCD06195414
O=C(C(Cn1ncc(c1)(N+)(=O)(O))C)NN=C(c1ccc(cc1)OCc1ccc(o1)C(=O)O)C
ZINC000008815650
ZINC000008815651
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.