Vitas-M small molecule compound
5-(furan-2-yl)-4-{[(E)-(2,4,6-trimethoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STK599339
SMILES COc1cc(OC)cc(c1/C=N/n1c(=S)[nH]nc1c1ccco1)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 C16H16N4O4S MW 360.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N4O4S/c1-21-10-7-13(22-2)11(14(8-10)23-3)9-17-20-15(18-19-16(20)25)12-5-4-6-24-12/h4-9H,1-3H3,(H,19,25)/b17-9+InChIKey
DDGQQQPMRNNKEK-RQZCQDPDSA-NSynonyms
489423-69-03(FURAN2YL)4((E)(246TRIMETHOXYPHENYL)METHYLIDENEAMINO)1H124TRIAZOLE5THIONE
4((1E)2(246TRIMETHOXYPHENYL)1AZAVINYL)5(2FURYL)124TRIAZOLE3THIOL
489423690
5(furan2yl)4(((E)(246trimethoxyphenyl)methylidene)amino)24dihydro3H124triazole3thione
COC1=CC(=C(C(=C1)OC)C=NN2C(=NNC2=S)C3=CC=CO3)OC
COc1cc(OC)cc(c1C=Nn1c(=S)(nH)nc1c1ccco1)OC
InChI=1SC16H16N4O4Sc12110713(222)11(14(810)233)9172015(181916(20)25)125462412h49H13H3(H1925)b179+
MFCD07201275
ZINC000005558300
ZINC1088345
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