Vitas-M small molecule compound
5-{[(6-bromonaphthalen-2-yl)oxy]methyl}-4-(butan-2-yl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STK306361
SMILES CCC(n1c(COc2ccc3c(c2)ccc(c3)Br)nnc1S)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 C17H18BrN3OS MW 392.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18BrN3OS/c1-3-11(2)21-16(19-20-17(21)23)10-22-15-7-5-12-8-14(18)6-4-13(12)9-15/h4-9,11H,3,10H2,1-2H3,(H,20,23)InChIKey
LSNGJWLYDZSMBH-UHFFFAOYSA-NSynonyms
828278-61-13((6BROMONAPHTHALEN2YL)OXYMETHYL)4BUTAN2YL1H124TRIAZOLE5THIONE
5(((6bromonaphthalen2yl)oxy)methyl)4(butan2yl)4H124triazole3thiol
828278611
CCC(C)N1C(=NNC1=S)COC2=CC3=C(C=C2)C=C(C=C3)Br
InChI=1SC17H18BrN3OSc1311(2)2116(192017(21)23)1022157512814(18)6413(12)915h4911H310H212H3(H2023)
MFCD04056307
ZINC000008326231
ZINC000008326958
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