Vitas-M small molecule compound

N-{[2-(2,4-dichlorophenyl)-1,3-benzoxazol-5-yl]carbamothioyl}-3-fluorobenzamide

Catalog ID
STK259315
SMILES S=C(NC(=O)c1cccc(c1)F)Nc1ccc2c(c1)nc(o2)c1ccc(cc1Cl)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 C21H12Cl2FN3O2S MW 460.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H12Cl2FN3O2S/c22-12-4-6-15(16(23)9-12)20-26-17-10-14(5-7-18(17)29-20)25-21(30)27-19(28)11-2-1-3-13(24)8-11/h1-10H,(H2,25,27,28,30)
InChIKey
ZECDBZJJHRYBRJ-UHFFFAOYSA-N
Synonyms

C1=CC(=CC(=C1)F)C(=O)NC(=S)NC2=CC3=C(C=C2)OC(=N3)C4=C(C=C(C=C4)Cl)Cl
InChI=1SC21H12Cl2FN3O2Sc22124615(16(23)912)2026171014(5718(17)2920)2521(30)2719(28)1121313(24)811h110H(H225272830)
MFCD03135274
N((2(24dichlorophenyl)13benzoxazol5yl)carbamothioyl)3fluorobenzamide
ZINC000002982969
ZINC02982969
ZINC2982969

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Available files

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