Vitas-M small molecule compound
5-(4-tert-butylphenyl)-4-{[(E)-(2,3,4-trimethoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STL044110
SMILES COc1ccc(c(c1OC)OC)/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 C22H26N4O3S MW 426.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N4O3S/c1-22(2,3)16-10-7-14(8-11-16)20-24-25-21(30)26(20)23-13-15-9-12-17(27-4)19(29-6)18(15)28-5/h7-13H,1-6H3,(H,25,30)/b23-13+InChIKey
PNJAOMLVMODPBJ-YDZHTSKRSA-NSynonyms
488855-14-73(4TERTBUTYLPHENYL)4((E)(234TRIMETHOXYPHENYL)METHYLIDENEAMINO)1H124TRIAZOLE5THIONE
488855147
5(4tertbutylphenyl)4(((E)(234trimethoxyphenyl)methylidene)amino)24dihydro3H124triazole3thione
COc1ccc(c(c1OC)OC)C=Nn1c(=S)(nH)nc1c1ccc(cc1)C(C)(C)C
InChI=1SC22H26N4O3Sc122(23)1610714(81116)20242521(30)26(20)23131591217(274)19(296)18(15)285h713H16H3(H2530)b2313+
MFCD03796140
ZINC000001473666
ZINC12467498
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