Vitas-M small molecule compound
N'-[(E)-(5-bromo-2-hydroxy-3-nitrophenyl)methylidene]-2-[(5-{[(4-iodophenyl)amino]methyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]propanehydrazide
Catalog ID
STL171303
SMILES O=C(C(Sc1nnc(n1c1ccccc1)CNc1ccc(cc1)I)C)N/N=C/c1cc(Br)cc(c1O)[N+](=O)[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 C25H21BrIN7O4S MW 722.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21BrIN7O4S/c1-15(24(36)31-29-13-16-11-17(26)12-21(23(16)35)34(37)38)39-25-32-30-22(33(25)20-5-3-2-4-6-20)14-28-19-9-7-18(27)8-10-19/h2-13,15,28,35H,14H2,1H3,(H,31,36)/b29-13+InChIKey
NWBVUVUAWRJNEX-VFLNYLIXSA-NSynonyms
MFCD01432719
N((E)(5bromo2hydroxy3nitrophenyl)methylidene)2((5(((4iodophenyl)amino)methyl)4phenyl4H124triazol3yl)sulfanyl)propanehydrazide
O=C(C(Sc1nnc(n1c1ccccc1)CNc1ccc(cc1)I)C)NN=Cc1cc(Br)cc(c1O)(N+)(=O)(O)
ZINC000097959379
ZINC000097959380
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