Vitas-M small molecule compound

4-{[(E)-(4-bromothiophen-2-yl)methylidene]amino}-5-(furan-2-yl)-4H-1,2,4-triazole-3-thiol

Catalog ID
STL173275
SMILES Brc1csc(c1)/C=N/n1c(S)nnc1c1ccco1

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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 C11H7BrN4OS2 MW 355.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H7BrN4OS2/c12-7-4-8(19-6-7)5-13-16-10(14-15-11(16)18)9-2-1-3-17-9/h1-6H,(H,15,18)/b13-5+
InChIKey
SKLFIRIVXJYTKD-WLRTZDKTSA-N
Synonyms
866736-56-3
4(((E)(4bromothiophen2yl)methylidene)amino)5(furan2yl)4H124triazole3thiol
4((E)(4bromothiophen2yl)methylideneamino)3(furan2yl)1H124triazole5thione
866736563
Brc1csc(c1)C=Nn1c(S)nnc1c1ccco1
C1=COC(=C1)C2=NNC(=S)N2N=CC3=CC(=CS3)Br
InChI=1SC11H7BrN4OS2c12748(1967)5131610(141511(16)18)9213179h16H(H1518)b135+
MFCD06195886
ZINC000008340085
ZINC38713125

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.