Vitas-M small molecule compound
1-[2-(benzylsulfanyl)-1H-benzimidazol-1-yl]-2-(4-bromophenoxy)ethanone
Catalog ID
STK701833
SMILES Brc1ccc(cc1)OCC(=O)n1c(SCc2ccccc2)nc2c1cccc2
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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 C22H17BrN2O2S MW 453.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17BrN2O2S/c23-17-10-12-18(13-11-17)27-14-21(26)25-20-9-5-4-8-19(20)24-22(25)28-15-16-6-2-1-3-7-16/h1-13H,14-15H2InChIKey
CINBEROBZBAEFO-UHFFFAOYSA-NSynonyms
1(2(benzylsulfanyl)1Hbenzimidazol1yl)2(4bromophenoxy)ethanone
1(2BENZYLSULFANYLBENZIMIDAZOL1YL)2(4BROMOPHENOXY)ETHANONE
C1=CC=C(C=C1)CSC2=NC3=CC=CC=C3N2C(=O)COC4=CC=C(C=C4)Br
InChI=1SC22H17BrN2O2Sc2317101218(131117)271421(26)2520954819(20)2422(25)2815166213716h113H1415H2
MFCD03461637
ZINC000016791049
ZINC16791049
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