Vitas-M small molecule compound
5-[1-(4-bromophenoxy)ethyl]-4-ethyl-4H-1,2,4-triazole-3-thiol
Catalog ID
STK502657
SMILES CCn1c(S)nnc1C(Oc1ccc(cc1)Br)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 C12H14BrN3OS MW 328.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H14BrN3OS/c1-3-16-11(14-15-12(16)18)8(2)17-10-6-4-9(13)5-7-10/h4-8H,3H2,1-2H3,(H,15,18)InChIKey
XUAUVCCHEHLJCW-UHFFFAOYSA-NSynonyms
862663-34-13(1(4bromophenoxy)ethyl)4ethyl1H124triazole5thione
5(1(4BROMOPHENOXY)ETHYL)4ETHYL124TRIAZOLE3THIOL
5(1(4BROMOPHENOXY)ETHYL)4ETHYL4H124TRIAZOLE3THIOL
862663341
CCN1C(=NNC1=S)C(C)OC2=CC=C(C=C2)Br
InChI=1SC12H14BrN3OSc131611(141512(16)18)8(2)1710649(13)5710h48H3H212H3(H1518)
MFCD04968908
ZINC000002536748
ZINC000015933427
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