Vitas-M small molecule compound
(4Z)-1-(3-chloro-4-methylphenyl)-4-[4-(4-methylpiperidin-1-yl)-3-nitrobenzylidene]pyrazolidine-3,5-dione
Catalog ID
STL169103
SMILES CC1CCN(CC1)c1ccc(cc1[N+](=O)[O-])/C=C\1/C(=O)NN(C1=O)c1ccc(c(c1)Cl)C
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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 C23H23ClN4O4 MW 454.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23ClN4O4/c1-14-7-9-26(10-8-14)20-6-4-16(12-21(20)28(31)32)11-18-22(29)25-27(23(18)30)17-5-3-15(2)19(24)13-17/h3-6,11-14H,7-10H2,1-2H3,(H,25,29)/b18-11-InChIKey
IEJUZSVZVPQRNT-WQRHYEAKSA-NSynonyms
(4Z)1(3CHLORO4METHYLPHENYL)4((4(4METHYLPIPERIDIN1YL)3NITROPHENYL)METHYLIDENE)PYRAZOLIDINE35DIONE
(4Z)1(3chloro4methylphenyl)4(4(4methylpiperidin1yl)3nitrobenzylidene)pyrazolidine35dione
CC1CCN(CC1)c1ccc(cc1(N+)(=O)(O))C=C1C(=O)NN(C1=O)c1ccc(c(c1)Cl)C
CC1CCN(CC1)C2=C(C=C(C=C2)C=C3C(=O)NN(C3=O)C4=CC(=C(C=C4)C)Cl)(N+)(=O)(O)
InChI=1SC23H23ClN4O4c1147926(10814)206416(1221(20)28(31)32)111822(29)2527(23(18)30)175315(2)19(24)1317h361114H710H212H3(H2529)b1811
MFCD01363533
ZINC000015658604
ZINC15658604
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