Vitas-M small molecule compound

(4Z)-4-(4-methoxybenzylidene)-5-(morpholin-4-yl)-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one

Catalog ID
STK332481
SMILES COc1ccc(cc1)/C=C/1\C(=O)N(N=C1N1CCOCC1)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 C21H20N4O5 MW 408.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O5/c1-29-18-8-2-15(3-9-18)14-19-20(23-10-12-30-13-11-23)22-24(21(19)26)16-4-6-17(7-5-16)25(27)28/h2-9,14H,10-13H2,1H3/b19-14-
InChIKey
YQJFOUSSQAUVOY-RGEXLXHISA-N
Synonyms

(4Z)4((4METHOXYPHENYL)METHYLIDENE)3(MORPHOLIN4YL)1(4NITROPHENYL)45DIHYDRO1HPYRAZOL5ONE
(4Z)4((4METHOXYPHENYL)METHYLIDENE)5MORPHOLIN4YL2(4NITROPHENYL)PYRAZOL3ONE
(4Z)4(4methoxybenzylidene)5(morpholin4yl)2(4nitrophenyl)24dihydro3Hpyrazol3one
(E)4(4methoxybenzylidene)3morpholino1(4nitrophenyl)1Hpyrazol5(4H)one
2(4NITROPHENYL)4(4METHOXYBENZYLIDENE)5(4MORPHOLINYL)24DIHYDRO3HPYRAZOL3ONE
4((4METHOXYPHENYL)METHYLENE)3MORPHOLIN4YL1(4NITROPHENYL)12DIAZOLIN5ONE
COC1=CC=C(C=C1)C=C2C(=NN(C2=O)C3=CC=C(C=C3)(N+)(=O)(O))N4CCOCC4
COc1ccc(cc1)C=C1C(=O)N(N=C1N1CCOCC1)c1ccc(cc1)(N+)(=O)(O)
COc1ccc(cc1)C=C1C(=O)N(N=C1N1CCOCC1)c1ccc(cc1)N(=O)=O
InChI=1SC21H20N4O5c129188215(3918)141920(23101230131123)2224(21(19)26)164617(7516)25(27)28h2914H1013H21H3b1914
MFCD00638967
ZINC000018067276
ZINC18067276

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Available files

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