Vitas-M small molecule compound
4-[(E)-(2-{[1-(4-ammonio-1,2,5-oxadiazol-3-yl)-5-{[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]-3-hydroxyphenolate
Catalog ID
STL057626
SMILES [O-]c1ccc(c(c1)O)/C=N/NC(=O)c1nnn(c1CSc1nncn1C)c1nonc1[NH3+]
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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 C16H15N11O4S MW 457.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15N11O4S/c1-26-7-19-22-16(26)32-6-10-12(20-25-27(10)14-13(17)23-31-24-14)15(30)21-18-5-8-2-3-9(28)4-11(8)29/h2-5,7,28-29H,6H2,1H3,(H2,17,23)(H,21,30)/b18-5+InChIKey
WTTRVVNMLIQGEN-BLLMUTORSA-NSynonyms
849026-43-3(O)c1ccc(c(c1)O)C=NNC(=O)c1nnn(c1CSc1nncn1C)c1nonc1(NH3+)
4((E)(2((1(4ammonio125oxadiazol3yl)5(((4methyl4H124triazol3yl)sulfanyl)methyl)1H123triazol4yl)carbonyl)hydrazinylidene)methyl)3hydroxyphenolate
849026433
MFCD05681406
ZINC000009411350
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