Vitas-M small molecule compound
5-[(2Z)-2-{1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-(4-nitrophenyl)-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene}hydrazinyl]-2,3-dihydrophthalazine-1,4-dione
Catalog ID
STK081651
SMILES COc1ccc(cc1)c1csc(n1)N1N=C(/C(=N/Nc2cccc3c2c(=O)[nH][nH]c3=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 C27H18N8O6S MW 582.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H18N8O6S/c1-41-17-11-7-14(8-12-17)20-13-42-27(28-20)34-26(38)23(22(33-34)15-5-9-16(10-6-15)35(39)40)30-29-19-4-2-3-18-21(19)25(37)32-31-24(18)36/h2-13,29H,1H3,(H,31,36)(H,32,37)/b30-23-InChIKey
OIMKFBXEAAARBS-WMMMYUQOSA-NSynonyms
5((2Z)2(1(4(4methoxyphenyl)13thiazol2yl)3(4nitrophenyl)5oxo15dihydro4Hpyrazol4ylidene)hydrazinyl)23dihydrophthalazine14dione
COc1ccc(cc1)c1csc(n1)N1N=C(C(=NNc2cccc3c2c(=O)(nH)(nH)c3=O)C1=O)c1ccc(cc1)(N+)(=O)(O)
MFCD02068048
STK081651
ZINC000100006022
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