Vitas-M small molecule compound
2-{[5-(4-bromophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(2,4,5-trimethoxyphenyl)methylidene]acetohydrazide
Catalog ID
STL071041
SMILES COc1cc(OC)c(cc1/C=N/NC(=O)CSc1nnc(n1c1ccccc1)c1ccc(cc1)Br)OC
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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 C26H24BrN5O4S MW 582.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24BrN5O4S/c1-34-21-14-23(36-3)22(35-2)13-18(21)15-28-29-24(33)16-37-26-31-30-25(17-9-11-19(27)12-10-17)32(26)20-7-5-4-6-8-20/h4-15H,16H2,1-3H3,(H,29,33)/b28-15+InChIKey
DBSLSPOJDSKFRA-RWPZCVJISA-NSynonyms
(E)2((5(4bromophenyl)4phenyl4H124triazol3yl)thio)N(245trimethoxybenzylidene)acetohydrazide
2((5(4BROMOPHENYL)4PHENYL124TRIAZOL3YL)SULFANYL)N((E)(245TRIMETHOXYPHENYL)METHYLIDENEAMINO)ACETAMIDE
2((5(4bromophenyl)4phenyl4H124triazol3yl)sulfanyl)N((E)(245trimethoxyphenyl)methylidene)acetohydrazide
COC1=CC(=C(C=C1C=NNC(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=C(C=C4)Br)OC)OC
COc1cc(OC)c(cc1C=NNC(=O)CSc1nnc(n1c1ccccc1)c1ccc(cc1)Br)OC
InChI=1SC26H24BrN5O4Sc134211423(363)22(352)1318(21)15282924(33)163726313025(1791119(27)121017)32(26)207546820h415H16H213H3(H2933)b2815+
MFCD02074905
ZINC000001740460
ZINC102964992
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