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Vitas-M small molecule compound

4,4'-{[1-(4-fluorobenzyl)-1H-indol-3-yl]methanediyl}bis(3-methyl-1H-pyrazol-5-ol)

Catalog ID
STK085519
SMILES Fc1ccc(cc1)Cn1cc(c2c1cccc2)C(c1c(O)[nH]nc1C)c1c(O)[nH]nc1C

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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 C24H22FN5O2 MW 431.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22FN5O2/c1-13-20(23(31)28-26-13)22(21-14(2)27-29-24(21)32)18-12-30(19-6-4-3-5-17(18)19)11-15-7-9-16(25)10-8-15/h3-10,12,22H,11H2,1-2H3,(H2,26,28,31)(H2,27,29,32)
InChIKey
NFWLZUZBNZNKQN-UHFFFAOYSA-N
Synonyms

4((1((4FLUOROPHENYL)METHYL)3INDOLYL)(3METHYL5OXO12DIHYDROPYRAZOL4YL)METHYL)5METHYL12DIHYDROPYRAZOL3ONE
4((1((4FLUOROPHENYL)METHYL)INDOL3YL)(3METHYL5OXIDANYLIDENE12DIHYDROPYRAZOL4YL)METHYL)5METHYL12DIHYDROPYRAZOL3ONE
4((1((4FLUOROPHENYL)METHYL)INDOL3YL)(3METHYL5OXO12DIHYDROPYRAZOL4YL)METHYL)5METHYL12DIHYDROPYRAZOL3ONE
4((1(4FLUOROBENZYL)INDOL3YL)(3KETO5METHYL3PYRAZOLIN4YL)METHYL)5METHYL3PYRAZOLIN3ONE
44((1(4FLUOROBENZYL)1HINDOL3YL)METHANEDIYL)BIS(3METHYL1HPYRAZOL5OL)
44((1(4FLUOROBENZYL)1HINDOL3YL)METHYLENE)BIS(3METHYL1HPYRAZOL5OL)
CC1=C(C(=O)NN1)C(C2=CN(C3=CC=CC=C32)CC4=CC=C(C=C4)F)C5=C(NNC5=O)C
Fc1ccc(cc1)Cn1cc(c2c1cccc2)C(c1c(O)(nH)nc1C)c1c(O)(nH)nc1C
InChI=1SC24H22FN5O2c11320(23(31)282613)22(2114(2)272924(21)32)181230(19643517(18)19)11157916(25)10815h3101222H11H212H3(H2262831)(H2272932)
MFCD03993021
STK085519
ZINC000008690031
ZINC08690031
ZINC8690031

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.

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