Vitas-M small molecule compound

2-[(4-bromo-1,5-dimethyl-1H-pyrazol-3-yl)carbonyl]-N-(4-methylphenyl)hydrazinecarbothioamide

Catalog ID
STK301519
SMILES S=C(Nc1ccc(cc1)C)NNC(=O)c1nn(c(c1Br)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 C14H16BrN5OS MW 382.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H16BrN5OS/c1-8-4-6-10(7-5-8)16-14(22)18-17-13(21)12-11(15)9(2)20(3)19-12/h4-7H,1-3H3,(H,17,21)(H2,16,18,22)
InChIKey
YOSCMRSKKJRKNE-UHFFFAOYSA-N
Synonyms
512808-81-0
1((4BROMO15DIMETHYLPYRAZOLE3CARBONYL)AMINO)3(4METHYLPHENYL)THIOUREA
2((4bromo15dimethyl1Hpyrazol3yl)carbonyl)N(4methylphenyl)hydrazinecarbothioamide
512808810
CC1=CC=C(C=C1)NC(=S)NNC(=O)C2=NN(C(=C2Br)C)C
InChI=1SC14H16BrN5OSc184610(758)1614(22)181713(21)1211(15)9(2)20(3)1912h47H13H3(H1721)(H2161822)
MFCD03465573
ZINC000000650681
ZINC00650681
ZINC650681

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.