Vitas-M small molecule compound
N'-[(E)-(3-bromo-4-methoxyphenyl)methylidene]-2-{[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Catalog ID
STK791399
SMILES COc1ccc(cc1Br)/C=N/NC(=O)CSc1nnc(n1c1ccccc1)c1ccc(cc1)C(C)(C)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 C28H28BrN5O2S MW 578.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28BrN5O2S/c1-28(2,3)21-13-11-20(12-14-21)26-32-33-27(34(26)22-8-6-5-7-9-22)37-18-25(35)31-30-17-19-10-15-24(36-4)23(29)16-19/h5-17H,18H2,1-4H3,(H,31,35)/b30-17+InChIKey
MJYGYQSLIBPSCA-OCSSWDANSA-NSynonyms
303105-59-1(E)N(3bromo4methoxybenzylidene)2((5(4(tertbutyl)phenyl)4phenyl4H124triazol3yl)thio)acetohydrazide
303105591
CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)SCC(=O)NN=CC4=CC(=C(C=C4)OC)Br
COc1ccc(cc1Br)C=NNC(=O)CSc1nnc(n1c1ccccc1)c1ccc(cc1)C(C)(C)C
InChI=1SC28H28BrN5O2Sc128(23)21131120(121421)26323327(34(26)228657922)371825(35)31301719101524(364)23(29)1619h517H18H214H3(H3135)b3017+
MFCD02641854
N((E)(3bromo4methoxyphenyl)methylidene)2((5(4tertbutylphenyl)4phenyl4H124triazol3yl)sulfanyl)acetohydrazide
N((E)(3BROMO4METHOXYPHENYL)METHYLIDENEAMINO)2((5(4TERTBUTYLPHENYL)4PHENYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000002591587
ZINC102809712
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