Vitas-M small molecule compound
2-fluoro-N-{[2-(4-methoxyphenyl)-1,3-benzoxazol-5-yl]carbamothioyl}benzamide
Catalog ID
STK184165
SMILES COc1ccc(cc1)c1oc2c(n1)cc(cc2)NC(=S)NC(=O)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/c1-28-15-9-6-13(7-10-15)21-25-18-12-14(8-11-19(18)29-21)24-22(30)26-20(27)16-4-2-3-5-17(16)23/h2-12H,1H3,(H2,24,26,27,30)InChIKey
VQJRDMGZNQNKJF-UHFFFAOYSA-NSynonyms
2FLUORON((2(4METHOXYPHENYL)13BENZOXAZOL5YL)CARBAMOTHIOYL)BENZAMIDE
COC1=CC=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=S)NC(=O)C4=CC=CC=C4F
InChI=1SC22H16FN3O3Sc128159613(71015)2125181214(81119(18)2921)2422(30)2620(27)16423517(16)23h212H1H3(H224262730)
MFCD02917820
ZINC000002982392
ZINC02982392
ZINC2982392
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