Vitas-M small molecule compound
5-(4-tert-butylphenyl)-4-{[(E)-(2,4-dimethoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STL150709
SMILES COc1ccc(c(c1)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 C21H24N4O2S MW 396.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N4O2S/c1-21(2,3)16-9-6-14(7-10-16)19-23-24-20(28)25(19)22-13-15-8-11-17(26-4)12-18(15)27-5/h6-13H,1-5H3,(H,24,28)/b22-13+InChIKey
RKYBAESJLBUUON-LPYMAVHISA-NSynonyms
488108-42-53(4TERTBUTYLPHENYL)4((E)(24DIMETHOXYPHENYL)METHYLIDENEAMINO)1H124TRIAZOLE5THIONE
488108425
5(4tertbutylphenyl)4(((E)(24dimethoxyphenyl)methylidene)amino)24dihydro3H124triazole3thione
COc1ccc(c(c1)OC)C=Nn1c(=S)(nH)nc1c1ccc(cc1)C(C)(C)C
InChI=1SC21H24N4O2Sc121(23)169614(71016)19232420(28)25(19)22131581117(264)1218(15)275h613H15H3(H2428)b2213+
MFCD03806264
ZINC000002328928
ZINC13941008
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