Vitas-M small molecule compound
(4Z)-3-(4-nitrophenyl)-5-oxo-4-[2-(2,4,6-tribromophenyl)hydrazinylidene]-4,5-dihydro-1H-pyrazole-1-carbothioamide
Catalog ID
STK057358
SMILES Brc1cc(Br)c(c(c1)Br)N/N=C\1/C(=NN(C1=O)C(=S)N)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 C16H9Br3N6O3S MW 605.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H9Br3N6O3S/c17-8-5-10(18)13(11(19)6-8)21-22-14-12(23-24(15(14)26)16(20)29)7-1-3-9(4-2-7)25(27)28/h1-6,21H,(H2,20,29)/b22-14-InChIKey
DVMDXYPHLKNECL-HMAPJEAMSA-NSynonyms
(4Z)3(4NITROPHENYL)5OXO4((246TRIBROMOPHENYL)HYDRAZINYLIDENE)PYRAZOLE1CARBOTHIOAMIDE
(4Z)3(4NITROPHENYL)5OXO4(2(246TRIBROMOPHENYL)HYDRAZINYLIDENE)45DIHYDRO1HPYRAZOLE1CARBOTHIOAMIDE
Brc1cc(Br)c(c(c1)Br)NN=C1C(=NN(C1=O)C(=S)N)c1ccc(cc1)(N+)(=O)(O)
C1=CC(=CC=C1C2=NN(C(=O)C2=NNC3=C(C=C(C=C3Br)Br)Br)C(=S)N)(N+)(=O)(O)
InChI=1SC16H9Br3N6O3Sc178510(18)13(11(19)68)21221412(2324(15(14)26)16(20)29)7139(427)25(27)28h1621H(H22029)b2214
MFCD01418636
STK057358
ZINC000004179658
ZINC100006062
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