Vitas-M small molecule compound
2-{(E)-[2-({1-(4-ammonio-1,2,5-oxadiazol-3-yl)-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazol-4-yl}carbonyl)hydrazinylidene]methyl}-4-bromophenolate
Catalog ID
STL048927
SMILES Brc1ccc(c(c1)/C=N/NC(=O)c1nnn(c1CSc1ccccc1)c1nonc1[NH3+])[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 C19H15BrN8O3S MW 515.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15BrN8O3S/c20-12-6-7-15(29)11(8-12)9-22-24-19(30)16-14(10-32-13-4-2-1-3-5-13)28(27-23-16)18-17(21)25-31-26-18/h1-9,29H,10H2,(H2,21,25)(H,24,30)/b22-9+InChIKey
HDNLYBACAHMNAZ-LSFURLLWSA-NSynonyms
573936-79-5573936795
Brc1ccc(c(c1)C=NNC(=O)c1nnn(c1CSc1ccccc1)c1nonc1(NH3+))(O)
MFCD04020162
ZINC000001875775
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