Vitas-M small molecule compound
5-{5-[(4-bromophenoxy)methyl]furan-2-yl}-4-(2-methylpropyl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STL173929
SMILES CC(Cn1c(S)nnc1c1ccc(o1)COc1ccc(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 C17H18BrN3O2S MW 408.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18BrN3O2S/c1-11(2)9-21-16(19-20-17(21)24)15-8-7-14(23-15)10-22-13-5-3-12(18)4-6-13/h3-8,11H,9-10H2,1-2H3,(H,20,24)InChIKey
XUEKKPUZWWNHOA-UHFFFAOYSA-NSynonyms
3(5((4BROMOPHENOXY)METHYL)FURAN2YL)4(2METHYLPROPYL)1H124TRIAZOLE5THIONE
5(5((4bromophenoxy)methyl)furan2yl)4(2methylpropyl)4H124triazole3thiol
CC(C)CN1C(=NNC1=S)C2=CC=C(O2)COC3=CC=C(C=C3)Br
InChI=1SC17H18BrN3O2Sc111(2)92116(192017(21)24)158714(2315)1022135312(18)4613h3811H910H212H3(H2024)
MFCD04130219
ZINC000002791814
ZINC02791814
ZINC2791814
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