Vitas-M small molecule compound
5-[(4-cyclohexylphenoxy)methyl]-2-[(4-methylpiperidin-1-yl)methyl]-4-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STK664414
SMILES CC1CCN(CC1)Cn1nc(n(c1=S)c1ccccc1)COc1ccc(cc1)C1CCCCC1
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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 C28H36N4OS MW 476.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H36N4OS/c1-22-16-18-30(19-17-22)21-31-28(34)32(25-10-6-3-7-11-25)27(29-31)20-33-26-14-12-24(13-15-26)23-8-4-2-5-9-23/h3,6-7,10-15,22-23H,2,4-5,8-9,16-21H2,1H3InChIKey
YFUAXWWGCSAOAQ-UHFFFAOYSA-NSynonyms
5((4CYCLOHEXYLPHENOXY)METHYL)2((4METHYLPIPERIDIN1YL)METHYL)4PHENYL124TRIAZOLE3THIONE
5((4cyclohexylphenoxy)methyl)2((4methylpiperidin1yl)methyl)4phenyl24dihydro3H124triazole3thione
CC1CCN(CC1)CN2C(=S)N(C(=N2)COC3=CC=C(C=C3)C4CCCCC4)C5=CC=CC=C5
InChI=1SC28H36N4OSc122161830(191722)213128(34)32(25106371125)27(2931)203326141224(131526)238425923h36710152223H245891621H21H3
MFCD01414418
ZINC000008853414
ZINC8853414
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