Vitas-M small molecule compound
4-bromo-N-{[2-(2-methylphenyl)-1,3-benzoxazol-5-yl]carbamothioyl}benzamide
Catalog ID
STL377628
SMILES S=C(NC(=O)c1ccc(cc1)Br)Nc1ccc2c(c1)nc(o2)c1ccccc1C
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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/c1-13-4-2-3-5-17(13)21-25-18-12-16(10-11-19(18)28-21)24-22(29)26-20(27)14-6-8-15(23)9-7-14/h2-12H,1H3,(H2,24,26,27,29)InChIKey
HRRAJIYMUFCBPU-UHFFFAOYSA-NSynonyms
4bromoN((2(2methylphenyl)13benzoxazol5yl)carbamothioyl)benzamide
CC1=CC=CC=C1C2=NC3=C(O2)C=CC(=C3)NC(=S)NC(=O)C4=CC=C(C=C4)Br
InChI=1SC22H16BrN3O2Sc113423517(13)2125181216(101119(18)2821)2422(29)2620(27)146815(23)9714h212H1H3(H224262729)
MFCD02802528
ZINC000003770749
ZINC03770749
ZINC3770749
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