Vitas-M small molecule compound
4-(4-methoxyphenyl)-5-(phenoxymethyl)-2-(piperidin-1-ylmethyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STL186046
SMILES COc1ccc(cc1)n1c(COc2ccccc2)nn(c1=S)CN1CCCCC1
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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 C22H26N4O2S MW 410.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N4O2S/c1-27-19-12-10-18(11-13-19)26-21(16-28-20-8-4-2-5-9-20)23-25(22(26)29)17-24-14-6-3-7-15-24/h2,4-5,8-13H,3,6-7,14-17H2,1H3InChIKey
GULKUNHACYRBDQ-UHFFFAOYSA-NSynonyms
4(4methoxyphenyl)5(phenoxymethyl)2(piperidin1ylmethyl)124triazole3thione
4(4methoxyphenyl)5(phenoxymethyl)2(piperidin1ylmethyl)24dihydro3H124triazole3thione
COC1=CC=C(C=C1)N2C(=NN(C2=S)CN3CCCCC3)COC4=CC=CC=C4
InChI=1SC22H26N4O2Sc12719121018(111319)2621(1628208425920)2325(22(26)29)1724146371524h245813H3671417H21H3
MFCD22387681
ZINC000072329969
ZINC72329969
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