Vitas-M small molecule compound
(4Z)-2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-5-(4-nitrophenyl)-4-[2-(4-nitrophenyl)hydrazinylidene]-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK059630
SMILES COc1ccc(cc1)c1csc(n1)N1N=C(/C(=N/Nc2ccc(cc2)[N+](=O)[O-])/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 C25H17N7O6S MW 543.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H17N7O6S/c1-38-20-12-4-15(5-13-20)21-14-39-25(26-21)30-24(33)23(28-27-17-6-10-19(11-7-17)32(36)37)22(29-30)16-2-8-18(9-3-16)31(34)35/h2-14,27H,1H3/b28-23-InChIKey
XBOFCRFKUAINST-NFFVHWSESA-NSynonyms
(4Z)2(4(4METHOXYPHENYL)13THIAZOL2YL)5(4NITROPHENYL)4((4NITROPHENYL)HYDRAZINYLIDENE)PYRAZOL3ONE
(4Z)2(4(4METHOXYPHENYL)13THIAZOL2YL)5(4NITROPHENYL)4(2(4NITROPHENYL)HYDRAZINYLIDENE)24DIHYDRO3HPYRAZOL3ONE
COC1=CC=C(C=C1)C2=CSC(=N2)N3C(=O)C(=NNC4=CC=C(C=C4)(N+)(=O)(O))C(=N3)C5=CC=C(C=C5)(N+)(=O)(O)
COc1ccc(cc1)c1csc(n1)N1N=C(C(=NNc2ccc(cc2)(N+)(=O)(O))C1=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC25H17N7O6Sc1382012415(51320)21143925(2621)3024(33)23(28271761019(11717)32(36)37)22(2930)162818(9316)31(34)35h21427H1H3b2823
MFCD01418550
STK059630
ZINC000101454779
ZINC101454781
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.