Vitas-M small molecule compound

N'-[(1E,2E)-3-(2-methoxyphenyl)prop-2-en-1-ylidene]-3-(3-nitrophenyl)-1H-pyrazole-5-carbohydrazide

Catalog ID
STK103008
SMILES COc1ccccc1/C=C/C=N/NC(=O)c1[nH]nc(c1)c1cccc(c1)[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 C20H17N5O4 MW 391.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17N5O4/c1-29-19-10-3-2-6-14(19)8-5-11-21-24-20(26)18-13-17(22-23-18)15-7-4-9-16(12-15)25(27)28/h2-13H,1H3,(H,22,23)(H,24,26)/b8-5+,21-11+
InChIKey
BROVGHOBXDWSTP-JPDQMXGXSA-N
Synonyms
307975-91-3
(E)N((E)3(2methoxyphenyl)allylidene)3(3nitrophenyl)1Hpyrazole5carbohydrazide
307975913
COC1=CC=CC=C1C=CC=NNC(=O)C2=CC(=NN2)C3=CC(=CC=C3)(N+)(=O)(O)
COc1ccccc1C=CC=NNC(=O)c1(nH)nc(c1)c1cccc(c1)(N+)(=O)(O)
InChI=1SC20H17N5O4c129191032614(19)8511212420(26)181317(222318)1574916(1215)25(27)28h213H1H3(H2223)(H2426)b85+2111+
MFCD01915166
N((1E2E)3(2METHOXYPHENYL)PROP2EN1YLIDENE)3(3NITROPHENYL)1HPYRAZOLE5CARBOHYDRAZIDE
N((1E3E)4(2METHOXYPHENYL)1AZABUTA13DIENYL)(3(3NITROPHENYL)PYRAZOL5YL)CARBOXAMIDE
N((E)((E)3(2METHOXYPHENYL)PROP2ENYLIDENE)AMINO)3(3NITROPHENYL)1HPYRAZOLE5CARBOXAMIDE
N(3(2METHOXYPHENYL)ALLYLIDENE)5(3NITROPHENYL)1HPYRAZOLE3CARBOHYDRAZIDE
ZINC000004033865
ZINC33929238

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Available files

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