Vitas-M small molecule compound
4-({(E)-[4-(benzyloxy)-3-methoxyphenyl]methylidene}amino)-5-(4-fluorophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STK588672
SMILES COc1cc(ccc1OCc1ccccc1)/C=N/n1c(=S)[nH]nc1c1ccc(cc1)F
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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 C23H19FN4O2S MW 434.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19FN4O2S/c1-29-21-13-17(7-12-20(21)30-15-16-5-3-2-4-6-16)14-25-28-22(26-27-23(28)31)18-8-10-19(24)11-9-18/h2-14H,15H2,1H3,(H,27,31)/b25-14+InChIKey
LAWSPIYCIORELD-AFUMVMLFSA-NSynonyms
677779-89-43(4fluorophenyl)4((E)(3methoxy4phenylmethoxyphenyl)methylideneamino)1H124triazole5thione
4(((E)(4(benzyloxy)3methoxyphenyl)methylidene)amino)5(4fluorophenyl)24dihydro3H124triazole3thione
4((1E)2(3METHOXY4(PHENYLMETHOXY)PHENYL)1AZAVINYL)5(4FLUOROPHENYL)124TRIAZOLE3THIOL
677779894
COC1=C(C=CC(=C1)C=NN2C(=NNC2=S)C3=CC=C(C=C3)F)OCC4=CC=CC=C4
COc1cc(ccc1OCc1ccccc1)C=Nn1c(=S)(nH)nc1c1ccc(cc1)F
InChI=1SC23H19FN4O2Sc129211317(71220(21)3015165324616)14252822(262723(28)31)1881019(24)11918h214H15H21H3(H2731)b2514+
MFCD07199431
ZINC000009108799
ZINC33367989
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