Vitas-M small molecule compound

3-(4-ethoxy-3-methoxyphenyl)-N'-[(E)-(4-nitrophenyl)methylidene]-1H-pyrazole-5-carbohydrazide

Catalog ID
STK997921
SMILES CCOc1ccc(cc1OC)c1n[nH]c(c1)C(=O)N/N=C/c1ccc(cc1)[N+](=O)[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 C20H19N5O5 MW 409.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N5O5/c1-3-30-18-9-6-14(10-19(18)29-2)16-11-17(23-22-16)20(26)24-21-12-13-4-7-15(8-5-13)25(27)28/h4-12H,3H2,1-2H3,(H,22,23)(H,24,26)/b21-12+
InChIKey
NYGKPKKSPAELHW-CIAFOILYSA-N
Synonyms
1299384-67-0
(E)3(4ethoxy3methoxyphenyl)N(4nitrobenzylidene)1Hpyrazole5carbohydrazide
1299384670
3(4ethoxy3methoxyphenyl)N((E)(4nitrophenyl)methylidene)1Hpyrazole5carbohydrazide
3(4ETHOXY3METHOXYPHENYL)N((E)(4NITROPHENYL)METHYLIDENEAMINO)1HPYRAZOLE5CARBOXAMIDE
CCOC1=C(C=C(C=C1)C2=NNC(=C2)C(=O)NN=CC3=CC=C(C=C3)(N+)(=O)(O))OC
CCOc1ccc(cc1OC)c1n(nH)c(c1)C(=O)NN=Cc1ccc(cc1)(N+)(=O)(O)
InChI=1SC20H19N5O5c1330189614(1019(18)292)161117(232216)20(26)242112134715(8513)25(27)28h412H3H212H3(H2223)(H2426)b2112+
MFCD02671705
ZINC000001468611
ZINC33340493

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Available files

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