Vitas-M small molecule compound

(4Z)-5-(4-methoxyphenyl)-2-(4-nitrophenyl)-4-[(phenylamino)methylidene]-2,4-dihydro-3H-pyrazol-3-one

Catalog ID
STK143107
SMILES COc1ccc(cc1)C1=NN(C(=O)/C/1=C\Nc1ccccc1)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 C23H18N4O4 MW 414.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18N4O4/c1-31-20-13-7-16(8-14-20)22-21(15-24-17-5-3-2-4-6-17)23(28)26(25-22)18-9-11-19(12-10-18)27(29)30/h2-15,24H,1H3/b21-15-
InChIKey
YJAPLLFKEMNADH-QNGOZBTKSA-N
Synonyms

(4Z)4(ANILINOMETHYLIDENE)5(4METHOXYPHENYL)2(4NITROPHENYL)PYRAZOL3ONE
(4Z)5(4METHOXYPHENYL)2(4NITROPHENYL)4((PHENYLAMINO)METHYLIDENE)24DIHYDRO3HPYRAZOL3ONE
(E)3(4methoxyphenyl)1(4nitrophenyl)4((phenylamino)methylene)1Hpyrazol5(4H)one
COC1=CC=C(C=C1)C2=NN(C(=O)C2=CNC3=CC=CC=C3)C4=CC=C(C=C4)(N+)(=O)(O)
COc1ccc(cc1)C1=NN(C(=O)C1=CNc1ccccc1)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC23H18N4O4c1312013716(81420)2221(1524175324617)23(28)26(2522)1891119(121018)27(29)30h21524H1H3b2115
MFCD08679312
ZINC000013645139
ZINC13645139

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Available files

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