Vitas-M small molecule compound

5-[(2E)-2-{[3-(3-chloro-4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}hydrazinyl]-1,3-oxazole-4-carbonitrile

Catalog ID
STK881632
SMILES COc1ccc(cc1Cl)c1nn(cc1/C=N/Nc1ocnc1C#N)c1ccccc1

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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 C21H15ClN6O2 MW 418.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15ClN6O2/c1-29-19-8-7-14(9-17(19)22)20-15(11-25-26-21-18(10-23)24-13-30-21)12-28(27-20)16-5-3-2-4-6-16/h2-9,11-13,26H,1H3/b25-11+
InChIKey
VGEKZLVGCYGIGH-OPEKNORGSA-N
Synonyms

5((2E)2((3(3chloro4methoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)hydrazinyl)13oxazole4carbonitrile
5((2E)2((3(3chloro4methoxyphenyl)1phenylpyrazol4yl)methylidene)hydrazinyl)13oxazole4carbonitrile
COC1=C(C=C(C=C1)C2=NN(C=C2C=NNC3=C(N=CO3)C#N)C4=CC=CC=C4)Cl
COc1ccc(cc1Cl)c1nn(cc1C=NNc1ocnc1C#N)c1ccccc1
InChI=1SC21H15ClN6O2c129198714(917(19)22)2015(1125262118(1023)24133021)1228(2720)165324616h29111326H1H3b2511+
MFCD03529556
ZINC000026533165
ZINC102863981

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Available files

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