Vitas-M small molecule compound

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

Catalog ID
STK240846
SMILES S=C(NC(=O)c1ccc(cc1C)C)Nc1ccc2c(c1)nc(o2)c1ccc(cc1Cl)F

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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 C23H17ClFN3O2S MW 453.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17ClFN3O2S/c1-12-3-6-16(13(2)9-12)21(29)28-23(31)26-15-5-8-20-19(11-15)27-22(30-20)17-7-4-14(25)10-18(17)24/h3-11H,1-2H3,(H2,26,28,29,31)
InChIKey
QSUFZQAJXFZTNO-UHFFFAOYSA-N
Synonyms

CC1=CC(=C(C=C1)C(=O)NC(=S)NC2=CC3=C(C=C2)OC(=N3)C4=C(C=C(C=C4)F)Cl)C
InChI=1SC23H17ClFN3O2Sc1123616(13(2)912)21(29)2823(31)2615582019(1115)2722(3020)177414(25)1018(17)24h311H12H3(H226282931)
MFCD04077549
N((2(2chloro4fluorophenyl)13benzoxazol5yl)carbamothioyl)24dimethylbenzamide
ZINC000001849185
ZINC01849185
ZINC1849185

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Available files

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