Vitas-M small molecule compound
(4E)-4-[2-(2,5-dichlorophenyl)hydrazinylidene]-2-(4-nitrophenyl)-5-phenyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK079044
SMILES Clc1ccc(c(c1)N/N=C\1/C(=O)N(N=C1c1ccccc1)c1ccc(cc1)[N+](=O)[O-])Cl
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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 C21H13Cl2N5O3 MW 454.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H13Cl2N5O3/c22-14-6-11-17(23)18(12-14)24-25-20-19(13-4-2-1-3-5-13)26-27(21(20)29)15-7-9-16(10-8-15)28(30)31/h1-12,24H/b25-20+InChIKey
WQGJYCJTJKSJKE-LKUDQCMESA-NSynonyms
(4E)4((25DICHLOROPHENYL)HYDRAZINYLIDENE)2(4NITROPHENYL)5PHENYLPYRAZOL3ONE
(4E)4(2(25DICHLOROPHENYL)HYDRAZINYLIDENE)2(4NITROPHENYL)5PHENYL24DIHYDRO3HPYRAZOL3ONE
C1=CC=C(C=C1)C2=NN(C(=O)C2=NNC3=C(C=CC(=C3)Cl)Cl)C4=CC=C(C=C4)(N+)(=O)(O)
Clc1ccc(c(c1)NN=C1C(=O)N(N=C1c1ccccc1)c1ccc(cc1)(N+)(=O)(O))Cl
InChI=1SC21H13Cl2N5O3c221461117(23)18(1214)24252019(134213513)2627(21(20)29)157916(10815)28(30)31h11224Hb2520+
MFCD01418820
STK079044
ZINC000100006082
ZINC12376585
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