Vitas-M small molecule compound

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

Catalog ID
STK163677
SMILES S=C(NC(=O)c1ccccc1F)Nc1ccc(cc1)c1nc2c(o1)ccc(c2)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 C21H13ClFN3O2S MW 425.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H13ClFN3O2S/c22-13-7-10-18-17(11-13)25-20(28-18)12-5-8-14(9-6-12)24-21(29)26-19(27)15-3-1-2-4-16(15)23/h1-11H,(H2,24,26,27,29)
InChIKey
OOFNRFLSYMRIPZ-UHFFFAOYSA-N
Synonyms
6417-62-5
6417625
C1=CC=C(C(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C3=NC4=C(O3)C=CC(=C4)Cl)F
InChI=1SC21H13ClFN3O2Sc22137101817(1113)2520(2818)125814(9612)2421(29)2619(27)15312416(15)23h111H(H224262729)
MFCD03135227
N((4(5CHLORO13BENZOXAZOL2YL)PHENYL)CARBAMOTHIOYL)2FLUOROBENZAMIDE
ZINC000002982722
ZINC02982722
ZINC2982722

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Available files

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