Vitas-M small molecule compound
2-{[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(4-hydroxy-3-methoxyphenyl)methylidene]acetohydrazide
Catalog ID
STK017732
SMILES COc1cc(/C=N/NC(=O)CSc2nnc(n2c2ccccc2)c2ccc(cc2)C(C)(C)C)ccc1O
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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 C28H29N5O3S MW 515.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N5O3S/c1-28(2,3)21-13-11-20(12-14-21)26-31-32-27(33(26)22-8-6-5-7-9-22)37-18-25(35)30-29-17-19-10-15-23(34)24(16-19)36-4/h5-17,34H,18H2,1-4H3,(H,30,35)/b29-17+InChIKey
RWVCXUZFLNIAPX-STBIYBPSSA-NSynonyms
306752-22-7(E)2((5(4(tertbutyl)phenyl)4phenyl4H124triazol3yl)thio)N(4hydroxy3methoxybenzylidene)acetohydrazide
2((5(4tertbutylphenyl)4phenyl4H124triazol3yl)sulfanyl)N((E)(4hydroxy3methoxyphenyl)methylidene)acetohydrazide
306752227
COc1cc(C=NNC(=O)CSc2nnc(n2c2ccccc2)c2ccc(cc2)C(C)(C)C)ccc1O
MFCD03220951
STK017732
ZINC000002338384
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