Vitas-M small molecule compound

(4E)-4-[2-(3-methoxyphenyl)hydrazinylidene]-2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-5-phenyl-2,4-dihydro-3H-pyrazol-3-one

Catalog ID
STK037406
SMILES COc1ccc(cc1)c1csc(n1)N1N=C(/C(=N\Nc2cccc(c2)OC)/C1=O)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 C26H21N5O3S MW 483.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21N5O3S/c1-33-20-13-11-17(12-14-20)22-16-35-26(27-22)31-25(32)24(23(30-31)18-7-4-3-5-8-18)29-28-19-9-6-10-21(15-19)34-2/h3-16,28H,1-2H3/b29-24+
InChIKey
FATSMPDNYBKIDN-RMLRFSFXSA-N
Synonyms

(4E)4((3methoxyphenyl)hydrazinylidene)2(4(4methoxyphenyl)13thiazol2yl)5phenylpyrazol3one
(4E)4(2(3METHOXYPHENYL)HYDRAZINYLIDENE)2(4(4METHOXYPHENYL)13THIAZOL2YL)5PHENYL24DIHYDRO3HPYRAZOL3ONE
COC1=CC=C(C=C1)C2=CSC(=N2)N3C(=O)C(=NNC4=CC(=CC=C4)OC)C(=N3)C5=CC=CC=C5
COc1ccc(cc1)c1csc(n1)N1N=C(C(=NNc2cccc(c2)OC)C1=O)c1ccccc1
InChI=1SC26H21N5O3Sc13320131117(121420)22163526(2722)3125(32)24(23(3031)187435818)292819961021(1519)342h31628H12H3b2924+
MFCD01078333
STK037406
ZINC000013573892
ZINC100005842

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Available files

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