Vitas-M small molecule compound

N-{[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl}-2-(4-methylphenoxy)acetamide

Catalog ID
STK863739
SMILES O=C(NC(=S)Nc1cc(ccc1Cl)C(F)(F)F)COc1ccc(cc1)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 C17H14ClF3N2O2S MW 402.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14ClF3N2O2S/c1-10-2-5-12(6-3-10)25-9-15(24)23-16(26)22-14-8-11(17(19,20)21)4-7-13(14)18/h2-8H,9H2,1H3,(H2,22,23,24,26)
InChIKey
WPZOFPVEGSDHBX-UHFFFAOYSA-N
Synonyms

CC1=CC=C(C=C1)OCC(=O)NC(=S)NC2=C(C=CC(=C2)C(F)(F)F)Cl
InChI=1SC17H14ClF3N2O2Sc1102512(6310)25915(24)2316(26)2214811(17(1920)21)4713(14)18h28H9H21H3(H222232426)
MFCD02624730
N((2chloro5(trifluoromethyl)phenyl)carbamothioyl)2(4methylphenoxy)acetamide
N((2chloro5(trifluoromethyl)phenyl)carbamothioyl)2(ptolyloxy)acetamide
ZINC000001183954
ZINC01183954
ZINC1183954

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Available files

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