Vitas-M small molecule compound
2,4-dibromo-6-[(E)-{[3-sulfanyl-5-(1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazol-4-yl]imino}methyl]phenol
Catalog ID
STL167718
SMILES Brc1cc(/C=N/n2c(S)nnc2c2n[nH]c3c2CCC3)c(c(c1)Br)O
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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 C15H12Br2N6OS MW 484.17 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H12Br2N6OS/c16-8-4-7(13(24)10(17)5-8)6-18-23-14(21-22-15(23)25)12-9-2-1-3-11(9)19-20-12/h4-6,24H,1-3H2,(H,19,20)(H,22,25)/b18-6+InChIKey
FBXATQIIEDTAIG-NGYBGAFCSA-NSynonyms
(E)24dibromo6(((3mercapto5(1456tetrahydrocyclopenta(c)pyrazol3yl)4H124triazol4yl)imino)methyl)phenol
24dibromo6((E)((3sulfanyl5(1456tetrahydrocyclopenta(c)pyrazol3yl)4H124triazol4yl)imino)methyl)phenol
Brc1cc(C=Nn2c(S)nnc2c2n(nH)c3c2CCC3)c(c(c1)Br)O
MFCD05690892
ZINC000009308786
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