Vitas-M small molecule compound

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

Catalog ID
STK387381
SMILES CCCC(=O)NC(C(Cl)(Cl)Cl)NC(=S)Nc1ccc(cc1)/N=N/c1ccccc1

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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 C19H20Cl3N5OS MW 472.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20Cl3N5OS/c1-2-6-16(28)24-17(19(20,21)22)25-18(29)23-13-9-11-15(12-10-13)27-26-14-7-4-3-5-8-14/h3-5,7-12,17H,2,6H2,1H3,(H,24,28)(H2,23,25,29)/b27-26+
InChIKey
ULTCHVCSGSYBFV-CYYJNZCTSA-N
Synonyms

CCCC(=O)NC(C(Cl)(Cl)Cl)NC(=S)Nc1ccc(cc1)N=Nc1ccccc1
MFCD00268273
N(222trichloro1(((4((E)phenyldiazenyl)phenyl)carbamothioyl)amino)ethyl)butanamide
ZINC000018044674
ZINC000018067660

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Available files

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