Vitas-M small molecule compound
(4Z)-4-[2-(3-bromo-4-methylphenyl)hydrazinylidene]-5-(4-nitrophenyl)-2-(4-phenyl-1,3-thiazol-2-yl)-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK038052
SMILES O=C1N(N=C(/C/1=N/Nc1ccc(c(c1)Br)C)c1ccc(cc1)[N+](=O)[O-])c1scc(n1)c1ccccc1
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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 C25H17BrN6O3S MW 561.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H17BrN6O3S/c1-15-7-10-18(13-20(15)26)28-29-23-22(17-8-11-19(12-9-17)32(34)35)30-31(24(23)33)25-27-21(14-36-25)16-5-3-2-4-6-16/h2-14,28H,1H3/b29-23-InChIKey
LKDIODLSLFBMNB-FAJYDZGRSA-NSynonyms
(4Z)4((3bromo4methylphenyl)hydrazinylidene)5(4nitrophenyl)2(4phenyl13thiazol2yl)pyrazol3one
(4Z)4(2(3BROMO4METHYLPHENYL)HYDRAZINYLIDENE)5(4NITROPHENYL)2(4PHENYL13THIAZOL2YL)24DIHYDRO3HPYRAZOL3ONE
CC1=C(C=C(C=C1)NN=C2C(=NN(C2=O)C3=NC(=CS3)C4=CC=CC=C4)C5=CC=C(C=C5)(N+)(=O)(O))Br
InChI=1SC25H17BrN6O3Sc11571018(1320(15)26)28292322(1781119(12917)32(34)35)3031(24(23)33)252721(143625)165324616h21428H1H3b2923
MFCD01418532
O=C1N(N=C(C1=NNc1ccc(c(c1)Br)C)c1ccc(cc1)(N+)(=O)(O))c1scc(n1)c1ccccc1
STK038052
ZINC000100005811
ZINC08397528
ZINC8397528
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