Vitas-M small molecule compound
N'-[(E)-(2-hydroxy-5-methoxyphenyl)methylidene]-2-[(5-{[(4-iodo-2-methylphenyl)amino]methyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]propanehydrazide
Catalog ID
STL171273
SMILES COc1ccc(c(c1)/C=N/NC(=O)C(Sc1nnc(n1c1ccccc1)CNc1ccc(cc1C)I)C)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 C27H27IN6O3S MW 642.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27IN6O3S/c1-17-13-20(28)9-11-23(17)29-16-25-31-33-27(34(25)21-7-5-4-6-8-21)38-18(2)26(36)32-30-15-19-14-22(37-3)10-12-24(19)35/h4-15,18,29,35H,16H2,1-3H3,(H,32,36)/b30-15+InChIKey
OCPQRFLFXGVMLB-FJEPWZHXSA-NSynonyms
COc1ccc(c(c1)C=NNC(=O)C(Sc1nnc(n1c1ccccc1)CNc1ccc(cc1C)I)C)O
MFCD01431065
N((E)(2hydroxy5methoxyphenyl)methylidene)2((5(((4iodo2methylphenyl)amino)methyl)4phenyl4H124triazol3yl)sulfanyl)propanehydrazide
ZINC000150391684
ZINC000150391686
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