Vitas-M small molecule compound
2-bromo-N-{[2-(4-chlorophenyl)-1,3-benzoxazol-5-yl]carbamothioyl}benzamide
Catalog ID
STK096593
SMILES S=C(NC(=O)c1ccccc1Br)Nc1ccc2c(c1)nc(o2)c1ccc(cc1)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 C21H13BrClN3O2S MW 486.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H13BrClN3O2S/c22-16-4-2-1-3-15(16)19(27)26-21(29)24-14-9-10-18-17(11-14)25-20(28-18)12-5-7-13(23)8-6-12/h1-11H,(H2,24,26,27,29)InChIKey
BZFJOHFMEWSVRT-UHFFFAOYSA-NSynonyms
2BROMON((2(4CHLOROPHENYL)13BENZOXAZOL5YL)CARBAMOTHIOYL)BENZAMIDE
C1=CC=C(C(=C1)C(=O)NC(=S)NC2=CC3=C(C=C2)OC(=N3)C4=CC=C(C=C4)Cl)Br
InChI=1SC21H13BrClN3O2Sc2216421315(16)19(27)2621(29)24149101817(1114)2520(2818)125713(23)8612h111H(H224262729)
MFCD02630371
S=C(NC(=O)c1ccccc1Br)Nc1ccc2c(c1)nc(o2)c1ccc(cc1)Cl
STK096593
ZINC000002978431
ZINC02978431
ZINC2978431
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