Vitas-M small molecule compound

(4Z)-4-[2-(4-fluorophenyl)hydrazinylidene]-2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-5-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one

Catalog ID
STK033499
SMILES COc1ccc(cc1)c1csc(n1)N1N=C(/C(=N/Nc2ccc(cc2)F)/C1=O)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 C25H17FN6O4S MW 516.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H17FN6O4S/c1-36-20-12-4-15(5-13-20)21-14-37-25(27-21)31-24(33)23(29-28-18-8-6-17(26)7-9-18)22(30-31)16-2-10-19(11-3-16)32(34)35/h2-14,28H,1H3/b29-23-
InChIKey
HWIMRYBDMJAFKU-FAJYDZGRSA-N
Synonyms

(4Z)4((4FLUOROPHENYL)HYDRAZINYLIDENE)2(4(4METHOXYPHENYL)13THIAZOL2YL)5(4NITROPHENYL)PYRAZOL3ONE
(4Z)4(2(4FLUOROPHENYL)HYDRAZINYLIDENE)2(4(4METHOXYPHENYL)13THIAZOL2YL)5(4NITROPHENYL)24DIHYDRO3HPYRAZOL3ONE
COC1=CC=C(C=C1)C2=CSC(=N2)N3C(=O)C(=NNC4=CC=C(C=C4)F)C(=N3)C5=CC=C(C=C5)(N+)(=O)(O)
COc1ccc(cc1)c1csc(n1)N1N=C(C(=NNc2ccc(cc2)F)C1=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC25H17FN6O4Sc1362012415(51320)21143725(2721)3124(33)23(2928188617(26)7918)22(3031)1621019(11316)32(34)35h21428H1H3b2923
MFCD01418562
STK033499
ZINC000009144676
ZINC101418282

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Available files

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