Vitas-M small molecule compound
N'-[(E)-(5-bromo-2-hydroxy-3-nitrophenyl)methylidene]-2-[(5-{[(4-methylphenyl)amino]methyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]propanehydrazide
Catalog ID
STL171200
SMILES O=C(C(Sc1nnc(n1c1ccccc1)CNc1ccc(cc1)C)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 C26H24BrN7O4S MW 610.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24BrN7O4S/c1-16-8-10-20(11-9-16)28-15-23-30-32-26(33(23)21-6-4-3-5-7-21)39-17(2)25(36)31-29-14-18-12-19(27)13-22(24(18)35)34(37)38/h3-14,17,28,35H,15H2,1-2H3,(H,31,36)/b29-14+InChIKey
LKEXNMVIKDYWSF-IPPBACCNSA-NSynonyms
MFCD01432095
N((E)(5bromo2hydroxy3nitrophenyl)methylidene)2((5(((4methylphenyl)amino)methyl)4phenyl4H124triazol3yl)sulfanyl)propanehydrazide
O=C(C(Sc1nnc(n1c1ccccc1)CNc1ccc(cc1)C)C)NN=Cc1cc(Br)cc(c1O)(N+)(=O)(O)
ZINC000098045827
ZINC000098045828
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