Vitas-M small molecule compound
4-({(E)-[4-(benzyloxy)-3-methoxyphenyl]methylidene}amino)-5-(4-tert-butylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STL044212
SMILES COc1cc(ccc1OCc1ccccc1)/C=N/n1c(=S)[nH]nc1c1ccc(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 C27H28N4O2S MW 472.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N4O2S/c1-27(2,3)22-13-11-21(12-14-22)25-29-30-26(34)31(25)28-17-20-10-15-23(24(16-20)32-4)33-18-19-8-6-5-7-9-19/h5-17H,18H2,1-4H3,(H,30,34)/b28-17+InChIKey
WUBQVEQMKAFFSK-OGLMXYFKSA-NSynonyms
497083-65-53(4TERTBUTYLPHENYL)4((E)(3METHOXY4PHENYLMETHOXYPHENYL)METHYLIDENEAMINO)1H124TRIAZOLE5THIONE
4(((E)(4(benzyloxy)3methoxyphenyl)methylidene)amino)5(4tertbutylphenyl)24dihydro3H124triazole3thione
497083655
COc1cc(ccc1OCc1ccccc1)C=Nn1c(=S)(nH)nc1c1ccc(cc1)C(C)(C)C
InChI=1SC27H28N4O2Sc127(23)22131121(121422)25293026(34)31(25)281720101523(24(1620)324)3318198657919h517H18H214H3(H3034)b2817+
MFCD03800133
ZINC000002328127
ZINC12464225
Check stock
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