Vitas-M small molecule compound
3-(methylsulfanyl)-N-[(E)-(3,4,5-trimethoxyphenyl)methylidene]-4H-1,2,4-triazol-4-amine
Catalog ID
STL164334
SMILES COc1cc(/C=N/n2cnnc2SC)cc(c1OC)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 C13H16N4O3S MW 308.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16N4O3S/c1-18-10-5-9(6-11(19-2)12(10)20-3)7-15-17-8-14-16-13(17)21-4/h5-8H,1-4H3/b15-7+InChIKey
XJZPVBHXMZGWCX-VIZOYTHASA-NSynonyms
(E)N(3methylsulfanyl124triazol4yl)1(345trimethoxyphenyl)methanimine
3(methylsulfanyl)N((E)(345trimethoxyphenyl)methylidene)4H124triazol4amine
COC1=CC(=CC(=C1OC)OC)C=NN2C=NN=C2SC
COc1cc(C=Nn2cnnc2SC)cc(c1OC)OC
InChI=1SC13H16N4O3Sc1181059(611(192)12(10)203)715178141613(17)214h58H14H3b157+
MFCD00818003
ZINC000003110555
ZINC3110554
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