Vitas-M small molecule compound
4-({(E)-[4-(difluoromethoxy)-3-methoxyphenyl]methylidene}amino)-4H-1,2,4-triazole-3-thiol
Catalog ID
STL173418
SMILES COc1cc(ccc1OC(F)F)/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 C11H10F2N4O2S MW 300.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H10F2N4O2S/c1-18-9-4-7(2-3-8(9)19-10(12)13)5-15-17-6-14-16-11(17)20/h2-6,10H,1H3,(H,16,20)/b15-5+InChIKey
OYTPILULGNVHSK-PJQLUOCWSA-NSynonyms
866553-04-04(((E)(4(difluoromethoxy)3methoxyphenyl)methylidene)amino)4H124triazole3thiol
4((E)(4(difluoromethoxy)3methoxyphenyl)methylideneamino)1H124triazole5thione
866553040
COC1=C(C=CC(=C1)C=NN2C=NNC2=S)OC(F)F
COc1cc(ccc1OC(F)F)C=Nn1cnnc1S
InChI=1SC11H10F2N4O2Sc118947(238(9)1910(12)13)515176141611(17)20h2610H1H3(H1620)b155+
MFCD06195347
ZINC000036611079
ZINC96569137
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