Vitas-M small molecule compound

2,2-dimethyl-N-(2,2,2-trichloro-1-{[(2-hydroxyphenyl)carbamothioyl]amino}ethyl)propanamide

Catalog ID
STK387385
SMILES S=C(Nc1ccccc1O)NC(C(Cl)(Cl)Cl)NC(=O)C(C)(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 C14H18Cl3N3O2S MW 398.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H18Cl3N3O2S/c1-13(2,3)11(22)19-10(14(15,16)17)20-12(23)18-8-6-4-5-7-9(8)21/h4-7,10,21H,1-3H3,(H,19,22)(H2,18,20,23)
InChIKey
XOMJXSPJIQRWHK-UHFFFAOYSA-N
Synonyms

22DIMETHYLN(222TRICHLORO1(((2HYDROXYPHENYL)CARBAMOTHIOYL)AMINO)ETHYL)PROPANAMIDE
22DIMETHYLN(222TRICHLORO1((2HYDROXYPHENYL)CARBAMOTHIOYLAMINO)ETHYL)PROPANAMIDE
CC(C)(C)C(=O)NC(C(Cl)(Cl)Cl)NC(=S)NC1=CC=CC=C1O
InChI=1SC14H18Cl3N3O2Sc113(23)11(22)1910(14(1516)17)2012(23)18864579(8)21h471021H13H3(H1922)(H2182023)
MFCD00392406
ZINC000002707030
ZINC000002707031

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Available files

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