Vitas-M small molecule compound
(4Z)-2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-5-methyl-4-[2-(2-methyl-6-nitrophenyl)hydrazinylidene]-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK070038
SMILES Brc1ccc(cc1)c1csc(n1)N1N=C(/C(=N/Nc2c(C)cccc2[N+](=O)[O-])/C1=O)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 C20H15BrN6O3S MW 499.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15BrN6O3S/c1-11-4-3-5-16(27(29)30)17(11)23-24-18-12(2)25-26(19(18)28)20-22-15(10-31-20)13-6-8-14(21)9-7-13/h3-10,23H,1-2H3/b24-18-InChIKey
ROQTUECKOAGICC-MOHJPFBDSA-NSynonyms
(4Z)2(4(4BROMOPHENYL)13THIAZOL2YL)5METHYL4((2METHYL6NITROPHENYL)HYDRAZINYLIDENE)PYRAZOL3ONE
(4Z)2(4(4BROMOPHENYL)13THIAZOL2YL)5METHYL4(2(2METHYL6NITROPHENYL)HYDRAZINYLIDENE)24DIHYDRO3HPYRAZOL3ONE
Brc1ccc(cc1)c1csc(n1)N1N=C(C(=NNc2c(C)cccc2(N+)(=O)(O))C1=O)C
CC1=C(C(=CC=C1)(N+)(=O)(O))NN=C2C(=NN(C2=O)C3=NC(=CS3)C4=CC=C(C=C4)Br)C
InChI=1SC20H15BrN6O3Sc11143516(27(29)30)17(11)23241812(2)2526(19(18)28)202215(103120)136814(21)9713h31023H12H3b2418
MFCD01419001
STK070038
ZINC000009635625
ZINC100527804
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