Vitas-M small molecule compound
4-{[(E)-{3-[(4-chloro-3,5-dimethylphenoxy)methyl]-4-methoxyphenyl}methylidene]amino}-4H-1,2,4-triazole-3-thiol
Catalog ID
STL177600
SMILES COc1ccc(cc1COc1cc(C)c(c(c1)C)Cl)/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 C19H19ClN4O2S MW 402.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19ClN4O2S/c1-12-6-16(7-13(2)18(12)20)26-10-15-8-14(4-5-17(15)25-3)9-22-24-11-21-23-19(24)27/h4-9,11H,10H2,1-3H3,(H,23,27)/b22-9+InChIKey
OAYCCAADNJVMKL-LSFURLLWSA-NSynonyms
828284-60-24(((E)(3((4chloro35dimethylphenoxy)methyl)4methoxyphenyl)methylidene)amino)4H124triazole3thiol
4((E)(3((4chloro35dimethylphenoxy)methyl)4methoxyphenyl)methylideneamino)1H124triazole5thione
828284602
CC1=CC(=CC(=C1Cl)C)OCC2=C(C=CC(=C2)C=NN3C=NNC3=S)OC
COc1ccc(cc1COc1cc(C)c(c(c1)C)Cl)C=Nn1cnnc1S
InChI=1SC19H19ClN4O2Sc112616(713(2)18(12)20)261015814(4517(15)253)9222411212319(24)27h4911H10H213H3(H2327)b229+
MFCD04053691
ZINC000002791819
ZINC2791818
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