Vitas-M small molecule compound

4-{[(E)-(4-methoxy-3-{[2-(prop-2-en-1-yl)phenoxy]methyl}phenyl)methylidene]amino}-4H-1,2,4-triazole-3-thiol

Catalog ID
STK306394
SMILES C=CCc1ccccc1OCc1cc(ccc1OC)/C=N/n1cnnc1S

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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 C20H20N4O2S MW 380.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4O2S/c1-3-6-16-7-4-5-8-19(16)26-13-17-11-15(9-10-18(17)25-2)12-22-24-14-21-23-20(24)27/h3-5,7-12,14H,1,6,13H2,2H3,(H,23,27)/b22-12+
InChIKey
JAYRSVWJRULALL-WSDLNYQXSA-N
Synonyms
828279-08-9
4(((E)(4methoxy3((2(prop2en1yl)phenoxy)methyl)phenyl)methylidene)amino)4H124triazole3thiol
4((E)(4methoxy3((2prop2enylphenoxy)methyl)phenyl)methylideneamino)1H124triazole5thione
828279089
C=CCc1ccccc1OCc1cc(ccc1OC)C=Nn1cnnc1S
COC1=C(C=C(C=C1)C=NN2C=NNC2=S)COC3=CC=CC=C3CC=C
InChI=1SC20H20N4O2Sc13616745819(16)2613171115(91018(17)252)12222414212320(24)27h3571214H1613H22H3(H2327)b2212+
MFCD05666906
ZINC000008493070
ZINC2790178

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Available files

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