Vitas-M small molecule compound
2-{[5-{[(4-chlorophenyl)amino]methyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(3,5-dibromo-2-hydroxyphenyl)methylidene]propanehydrazide
Catalog ID
STL172508
SMILES C=CCn1c(nnc1CNc1ccc(cc1)Cl)SC(C(=O)N/N=C/c1cc(Br)cc(c1O)Br)C
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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 C22H21Br2ClN6O2S MW 628.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21Br2ClN6O2S/c1-3-8-31-19(12-26-17-6-4-16(25)5-7-17)28-30-22(31)34-13(2)21(33)29-27-11-14-9-15(23)10-18(24)20(14)32/h3-7,9-11,13,26,32H,1,8,12H2,2H3,(H,29,33)/b27-11+InChIKey
AVYULMIBNBYOQC-LUOAPIJWSA-NSynonyms
2((5(((4chlorophenyl)amino)methyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)N((E)(35dibromo2hydroxyphenyl)methylidene)propanehydrazide
C=CCn1c(nnc1CNc1ccc(cc1)Cl)SC(C(=O)NN=Cc1cc(Br)cc(c1O)Br)C
MFCD01436634
ZINC000008396923
ZINC000008396933
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