Vitas-M small molecule compound
2-bromo-N-{[4-(5-methyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}benzamide
Catalog ID
STL377362
SMILES S=C(NC(=O)c1ccccc1Br)Nc1ccc(cc1)c1nc2c(o1)ccc(c2)C
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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 C22H16BrN3O2S MW 466.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16BrN3O2S/c1-13-6-11-19-18(12-13)25-21(28-19)14-7-9-15(10-8-14)24-22(29)26-20(27)16-4-2-3-5-17(16)23/h2-12H,1H3,(H2,24,26,27,29)InChIKey
AVNIZHFFWZLZGW-UHFFFAOYSA-NSynonyms
2bromoN((4(5methyl13benzoxazol2yl)phenyl)carbamothioyl)benzamide
CC1=CC2=C(C=C1)OC(=N2)C3=CC=C(C=C3)NC(=S)NC(=O)C4=CC=CC=C4Br
InChI=1SC22H16BrN3O2Sc1136111918(1213)2521(2819)147915(10814)2422(29)2620(27)16423517(16)23h212H1H3(H224262729)
MFCD02630008
ZINC000002982251
ZINC02982251
ZINC2982251
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