Vitas-M small molecule compound
5-(3,4,5-trimethoxyphenyl)-4-{[(E)-(3,4,5-trimethoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STK577639
SMILES COc1c(OC)cc(cc1OC)/C=N/n1c(=S)[nH]nc1c1cc(OC)c(c(c1)OC)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 C21H24N4O6S MW 460.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N4O6S/c1-26-14-7-12(8-15(27-2)18(14)30-5)11-22-25-20(23-24-21(25)32)13-9-16(28-3)19(31-6)17(10-13)29-4/h7-11H,1-6H3,(H,24,32)/b22-11+InChIKey
UTAMWOQDFXNTEH-SSDVNMTOSA-NSynonyms
1233523-48-21233523482
3(345trimethoxyphenyl)4((E)(345trimethoxyphenyl)methylideneamino)1H124triazole5thione
4((1E)2(345TRIMETHOXYPHENYL)1AZAVINYL)5(345TRIMETHOXYPHENYL)124TRIAZOLE3THIOL
5(345trimethoxyphenyl)4(((E)(345trimethoxyphenyl)methylidene)amino)24dihydro3H124triazole3thione
COC1=CC(=CC(=C1OC)OC)C=NN2C(=NNC2=S)C3=CC(=C(C(=C3)OC)OC)OC
COc1c(OC)cc(cc1OC)C=Nn1c(=S)(nH)nc1c1cc(OC)c(c(c1)OC)OC
InChI=1SC21H24N4O6Sc12614712(815(272)18(14)305)11222520(232421(25)32)13916(283)19(316)17(1013)294h711H16H3(H2432)b2211+
MFCD07199332
ZINC000009108686
ZINC33352362
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