Vitas-M small molecule compound
4-({(E)-[3-(benzyloxy)-4-methoxyphenyl]methylidene}amino)-5-(4-chlorophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STK845882
SMILES COc1ccc(cc1OCc1ccccc1)/C=N/n1c(=S)[nH]nc1c1ccc(cc1)Cl
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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 C23H19ClN4O2S MW 450.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19ClN4O2S/c1-29-20-12-7-17(13-21(20)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
ZVFOCQHJJLUZRF-AFUMVMLFSA-NSynonyms
430448-45-63(4CHLOROPHENYL)4((E)(4METHOXY3PHENYLMETHOXYPHENYL)METHYLIDENEAMINO)1H124TRIAZOLE5THIONE
4(((E)(3(benzyloxy)4methoxyphenyl)methylidene)amino)5(4chlorophenyl)24dihydro3H124triazole3thione
430448456
COc1ccc(cc1OCc1ccccc1)C=Nn1c(=S)(nH)nc1c1ccc(cc1)Cl
InChI=1SC23H19ClN4O2Sc1292012717(1321(20)3015165324616)14252822(262723(28)31)1881019(24)11918h214H15H21H3(H2731)b2514+
MFCD03805692
ZINC000017138695
ZINC9762947
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