Vitas-M small molecule compound

2-(4-chloro-2-methylphenoxy)-N-{[2-(2-fluorophenyl)-1,3-benzoxazol-5-yl]carbamothioyl}acetamide

Catalog ID
STK236911
SMILES O=C(NC(=S)Nc1ccc2c(c1)nc(o2)c1ccccc1F)COc1ccc(cc1C)Cl

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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 C23H17ClFN3O3S MW 469.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17ClFN3O3S/c1-13-10-14(24)6-8-19(13)30-12-21(29)28-23(32)26-15-7-9-20-18(11-15)27-22(31-20)16-4-2-3-5-17(16)25/h2-11H,12H2,1H3,(H2,26,28,29,32)
InChIKey
GJIYKPYOSYOLJL-UHFFFAOYSA-N
Synonyms

2(4chloro2methylphenoxy)N((2(2fluorophenyl)13benzoxazol5yl)carbamothioyl)acetamide
CC1=C(C=CC(=C1)Cl)OCC(=O)NC(=S)NC2=CC3=C(C=C2)OC(=N3)C4=CC=CC=C4F
InChI=1SC23H17ClFN3O3Sc1131014(24)6819(13)301221(29)2823(32)2615792018(1115)2722(3120)16423517(16)25h211H12H21H3(H226282932)
MFCD03906756
ZINC000009190374
ZINC09190374
ZINC9190374

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Available files

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