Vitas-M small molecule compound
5-(4-tert-butylphenyl)-4-[(2,5-dimethoxybenzylidene)amino]-4H-1,2,4-triazole-3-thiol
Catalog ID
STK106340
SMILES COc1ccc(c(c1)/C=N/n1c(S)nnc1c1ccc(cc1)C(C)(C)C)OC
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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)16-8-6-14(7-9-16)19-23-24-20(28)25(19)22-13-15-12-17(26-4)10-11-18(15)27-5/h6-13H,1-5H3,(H,24,28)InChIKey
IVJSVVUOPQTKMG-UHFFFAOYSA-NSynonyms
(E)5(4(tertbutyl)phenyl)4((25dimethoxybenzylidene)amino)4H124triazole3thiol
3(4TERTBUTYLPHENYL)4((25DIMETHOXYPHENYL)METHYLIDENEAMINO)1H124TRIAZOLE5THIONE
4((1E)2(25DIMETHOXYPHENYL)1AZAVINYL)5(4(TERTBUTYL)PHENYL)124TRIAZOLE3THIOL
5(4TERTBUTYLPHENYL)4((25DIMETHOXYBENZYLIDENE)AMINO)24DIHYDRO3H124TRIAZOLE3THIONE
5(4TERTBUTYLPHENYL)4((25DIMETHOXYBENZYLIDENE)AMINO)4H124TRIAZOLE3THIOL
CC(C)(C)C1=CC=C(C=C1)C2=NNC(=S)N2N=CC3=C(C=CC(=C3)OC)OC
COc1ccc(c(c1)C=Nn1c(S)nnc1c1ccc(cc1)C(C)(C)C)OC
InChI=1SC21H24N4O2Sc121(23)168614(7916)19232420(28)25(19)2213151217(264)101118(15)275h613H15H3(H2428)
MFCD03218224
ZINC000239119565
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