Vitas-M small molecule compound

N-{2,2,2-trichloro-1-[({2-methyl-4-[(E)-(2-methylphenyl)diazenyl]phenyl}carbamothioyl)amino]ethyl}butanamide

Catalog ID
STK862058
SMILES CCCC(=O)NC(C(Cl)(Cl)Cl)NC(=S)Nc1ccc(cc1C)/N=N/c1ccccc1C

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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 C21H24Cl3N5OS MW 500.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24Cl3N5OS/c1-4-7-18(30)26-19(21(22,23)24)27-20(31)25-16-11-10-15(12-14(16)3)28-29-17-9-6-5-8-13(17)2/h5-6,8-12,19H,4,7H2,1-3H3,(H,26,30)(H2,25,27,31)/b29-28+
InChIKey
DNNBTOAOILLBAQ-ZQHSETAFSA-N
Synonyms

CCCC(=O)NC(C(Cl)(Cl)Cl)NC(=S)Nc1ccc(cc1C)N=Nc1ccccc1C
MFCD00268048
N(222trichloro1(((2methyl4((E)(2methylphenyl)diazenyl)phenyl)carbamothioyl)amino)ethyl)butanamide
ZINC000016790881
ZINC000016790883

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Available files

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