Vitas-M small molecule compound
5-(1-benzofuran-2-yl)-4-(4-methoxybenzyl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STL235864
SMILES COc1ccc(cc1)Cn1c(S)nnc1c1cc2c(o1)cccc2
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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 C18H15N3O2S MW 337.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15N3O2S/c1-22-14-8-6-12(7-9-14)11-21-17(19-20-18(21)24)16-10-13-4-2-3-5-15(13)23-16/h2-10H,11H2,1H3,(H,20,24)InChIKey
MMNPWZDEXJFMQY-UHFFFAOYSA-NSynonyms
587012-21-33(1BENZOFURAN2YL)4((4METHOXYPHENYL)METHYL)1H124TRIAZOLE5THIONE
5(1benzofuran2yl)4(4methoxybenzyl)4H124triazole3thiol
5(benzofuran2yl)4(4methoxybenzyl)4H124triazole3thiol
587012213
COC1=CC=C(C=C1)CN2C(=NNC2=S)C3=CC4=CC=CC=C4O3
InChI=1SC18H15N3O2Sc122148612(7914)112117(192018(21)24)161013423515(13)2316h210H11H21H3(H2024)
MFCD04034262
ZINC000005910834
ZINC00533528
ZINC5910834
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