Vitas-M small molecule compound

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

Catalog ID
STK083982
SMILES COc1cccc(c1)C(=O)NC(=S)Nc1ccc2c(c1)nc(o2)c1ccccc1F

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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 C22H16FN3O3S MW 421.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16FN3O3S/c1-28-15-6-4-5-13(11-15)20(27)26-22(30)24-14-9-10-19-18(12-14)25-21(29-19)16-7-2-3-8-17(16)23/h2-12H,1H3,(H2,24,26,27,30)
InChIKey
KWVHZRCFKLOSPZ-UHFFFAOYSA-N
Synonyms
428469-87-8
428469878
COC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC3=C(C=C2)OC(=N3)C4=CC=CC=C4F
COc1cccc(c1)C(=O)NC(=S)Nc1ccc2c(c1)nc(o2)c1ccccc1F
InChI=1SC22H16FN3O3Sc1281564513(1115)20(27)2622(30)24149101918(1214)2521(2919)16723817(16)23h212H1H3(H224262730)
MFCD02630906
N((2(2FLUOROPHENYL)13BENZOXAZOL5YL)CARBAMOTHIOYL)3METHOXYBENZAMIDE
N((2(2fluorophenyl)benzo(d)oxazol5yl)carbamothioyl)3methoxybenzamide
N(2(2FLUOROPHENYL)13BENZOXAZOL5YL)N(3METHOXYBENZOYL)THIOUREA
STK083982
ZINC000000724618
ZINC00724618
ZINC724618

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Available files

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