Vitas-M small molecule compound
2-(2-{[(6-bromo-1,3-benzodioxol-5-yl)methyl]sulfanyl}-1H-benzimidazol-1-yl)-N-tert-butylacetamide
Catalog ID
STK743897
SMILES O=C(NC(C)(C)C)Cn1c(SCc2cc3OCOc3cc2Br)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 C21H22BrN3O3S MW 476.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22BrN3O3S/c1-21(2,3)24-19(26)10-25-16-7-5-4-6-15(16)23-20(25)29-11-13-8-17-18(9-14(13)22)28-12-27-17/h4-9H,10-12H2,1-3H3,(H,24,26)InChIKey
RWIQZBZMHQGZMT-UHFFFAOYSA-NSynonyms
2(2(((6bromo13benzodioxol5yl)methyl)sulfanyl)1Hbenzimidazol1yl)Ntertbutylacetamide
2(2((6BROMO13BENZODIOXOL5YL)METHYLSULFANYL)BENZIMIDAZOL1YL)NTERTBUTYLACETAMIDE
CC(C)(C)NC(=O)CN1C2=CC=CC=C2N=C1SCC3=CC4=C(C=C3Br)OCO4
InChI=1SC21H22BrN3O3Sc121(23)2419(26)102516754615(16)2320(25)29111381718(914(13)22)28122717h49H1012H213H3(H2426)
MFCD06617028
ZINC000012364992
ZINC12364992
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