Vitas-M small molecule compound
N'-[(1E)-1-(4-bromophenyl)ethylidene]-2-{[5-(4-methoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Catalog ID
STL361930
SMILES COc1ccc(cc1)c1nnc(n1c1ccccc1)SCC(=O)N/N=C(/c1ccc(cc1)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 C25H22BrN5O2S MW 536.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22BrN5O2S/c1-17(18-8-12-20(26)13-9-18)27-28-23(32)16-34-25-30-29-24(19-10-14-22(33-2)15-11-19)31(25)21-6-4-3-5-7-21/h3-15H,16H2,1-2H3,(H,28,32)/b27-17+InChIKey
QQCFZKRTKFZRAS-WPWMEQJKSA-NSynonyms
(Z)N(1(4bromophenyl)ethylidene)2((5(4methoxyphenyl)4phenyl4H124triazol3yl)thio)acetohydrazide
CC(=NNC(=O)CSC1=NN=C(N1C2=CC=CC=C2)C3=CC=C(C=C3)OC)C4=CC=C(C=C4)Br
COc1ccc(cc1)c1nnc(n1c1ccccc1)SCC(=O)NN=C(c1ccc(cc1)Br)C
InChI=1SC25H22BrN5O2Sc117(1881220(26)13918)272823(32)163425302924(19101422(332)151119)31(25)216435721h315H16H212H3(H2832)b2717+
MFCD04122735
N((1E)1(4bromophenyl)ethylidene)2((5(4methoxyphenyl)4phenyl4H124triazol3yl)sulfanyl)acetohydrazide
N((E)1(4bromophenyl)ethylideneamino)2((5(4methoxyphenyl)4phenyl124triazol3yl)sulfanyl)acetamide
ZINC000100342197
ZINC97990102
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