Vitas-M small molecule compound
(4E)-2-(4-tert-butyl-1,3-thiazol-2-yl)-4-[2-(2,6-dichloro-4-nitrophenyl)hydrazinylidene]-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK046925
SMILES CC1=NN(C(=O)/C/1=N/Nc1c(Cl)cc(cc1Cl)[N+](=O)[O-])c1scc(n1)C(C)(C)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 C17H16Cl2N6O3S MW 455.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16Cl2N6O3S/c1-8-13(21-22-14-10(18)5-9(25(27)28)6-11(14)19)15(26)24(23-8)16-20-12(7-29-16)17(2,3)4/h5-7,22H,1-4H3/b21-13+InChIKey
FNEHUJFONNUUGX-FYJGNVAPSA-NSynonyms
(4E)2(4TERTBUTYL13THIAZOL2YL)4((26DICHLORO4NITROPHENYL)HYDRAZINYLIDENE)5METHYLPYRAZOL3ONE
(4E)2(4TERTBUTYL13THIAZOL2YL)4(2(26DICHLORO4NITROPHENYL)HYDRAZINYLIDENE)5METHYL24DIHYDRO3HPYRAZOL3ONE
1(4TERTBUTYL13THIAZOL2YL)3METHYL1HPYRAZOLE45DIONE4((26DICHLORO4NITROPHENYL)HYDRAZONE)
4(((26DICHLORO4NITROPHENYL)AMINO)AZAMETHYLENE)1(4(TERTBUTYL)(13THIAZOL2YL))3METHYL12DIAZOLIN5ONE
CC1=NN(C(=O)C1=NNc1c(Cl)cc(cc1Cl)(N+)(=O)(O))c1scc(n1)C(C)(C)C
CC1=NN(C(=O)C1=NNC2=C(C=C(C=C2Cl)(N+)(=O)(O))Cl)C3=NC(=CS3)C(C)(C)C
InChI=1SC17H16Cl2N6O3Sc1813(21221410(18)59(25(27)28)611(14)19)15(26)24(238)162012(72916)17(23)4h5722H14H3b2113+
MFCD01126567
STK046925
ZINC000100006098
ZINC12403908
Check stock
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Check stock on Vitas-MAvailable files
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