Vitas-M small molecule compound

3-[3-(benzyloxy)phenyl]-N'-[(1Z)-1-(4-nitrophenyl)ethylidene]-1H-pyrazole-5-carbohydrazide

Catalog ID
STK998300
SMILES O=C(c1[nH]nc(c1)c1cccc(c1)OCc1ccccc1)N/N=C(\c1ccc(cc1)[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 C25H21N5O4 MW 455.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21N5O4/c1-17(19-10-12-21(13-11-19)30(32)33)26-29-25(31)24-15-23(27-28-24)20-8-5-9-22(14-20)34-16-18-6-3-2-4-7-18/h2-15H,16H2,1H3,(H,27,28)(H,29,31)/b26-17-
InChIKey
KNPXHNRTWJFSLX-ONUIUJJFSA-N
Synonyms
1285646-95-8
(Z)3(3(benzyloxy)phenyl)N(1(4nitrophenyl)ethylidene)1Hpyrazole5carbohydrazide
1285646958
3(3(benzyloxy)phenyl)N((1Z)1(4nitrophenyl)ethylidene)1Hpyrazole5carbohydrazide
CC(=NNC(=O)C1=CC(=NN1)C2=CC(=CC=C2)OCC3=CC=CC=C3)C4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC25H21N5O4c117(19101221(131119)30(32)33)262925(31)241523(272824)2085922(1420)3416186324718h215H16H21H3(H2728)(H2931)b2617
MFCD03665195
N((1Z)2(4NITROPHENYL)1AZAPROP1ENYL)(3(3(PHENYLMETHOXY)PHENYL)PYRAZOL5YL)CARBOXAMIDE
N((Z)1(4NITROPHENYL)ETHYLIDENEAMINO)3(3PHENYLMETHOXYPHENYL)1HPYRAZOLE5CARBOXAMIDE
O=C(c1(nH)nc(c1)c1cccc(c1)OCc1ccccc1)NN=C(c1ccc(cc1)(N+)(=O)(O))C
ZINC000001468745
ZINC33340531

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.