Vitas-M small molecule compound

(4Z)-2-(4-nitrophenyl)-4-[2-(4-phenoxyphenyl)hydrazinylidene]-5-phenyl-2,4-dihydro-3H-pyrazol-3-one

Catalog ID
STK058354
SMILES O=C1N(N=C(/C/1=N/Nc1ccc(cc1)Oc1ccccc1)c1ccccc1)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 C27H19N5O4 MW 477.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H19N5O4/c33-27-26(29-28-20-11-17-24(18-12-20)36-23-9-5-2-6-10-23)25(19-7-3-1-4-8-19)30-31(27)21-13-15-22(16-14-21)32(34)35/h1-18,28H/b29-26-
InChIKey
XBAVGYGYZRJKEK-WCTVFOPTSA-N
Synonyms

(4Z)2(4NITROPHENYL)4((4PHENOXYPHENYL)HYDRAZINYLIDENE)5PHENYLPYRAZOL3ONE
(4Z)2(4NITROPHENYL)4(2(4PHENOXYPHENYL)HYDRAZINYLIDENE)5PHENYL24DIHYDRO3HPYRAZOL3ONE
1(4NITROPHENYL)3PHENYL1HPYRAZOLE45DIONE4((4PHENOXYPHENYL)HYDRAZONE)
C1=CC=C(C=C1)C2=NN(C(=O)C2=NNC3=CC=C(C=C3)OC4=CC=CC=C4)C5=CC=C(C=C5)(N+)(=O)(O)
InChI=1SC27H19N5O4c332726(292820111724(181220)362395261023)25(197314819)3031(27)21131522(161421)32(34)35h11828Hb2926
MFCD01079051
O=C1N(N=C(C1=NNc1ccc(cc1)Oc1ccccc1)c1ccccc1)c1ccc(cc1)(N+)(=O)(O)
STK058354
ZINC000008398155
ZINC100005977

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Available files

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