Vitas-M small molecule compound
5-(1-benzofuran-2-yl)-4-phenyl-2-(piperidin-1-ylmethyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STK629370
SMILES S=c1n(CN2CCCCC2)nc(n1c1ccccc1)c1cc2c(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 C22H22N4OS MW 390.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4OS/c28-22-25(16-24-13-7-2-8-14-24)23-21(26(22)18-10-3-1-4-11-18)20-15-17-9-5-6-12-19(17)27-20/h1,3-6,9-12,15H,2,7-8,13-14,16H2InChIKey
QJYRBCMAFAEIIZ-UHFFFAOYSA-NSynonyms
118059-04-4118059044
3(benzofuran2yl)4phenyl1(piperidin1ylmethyl)1H124triazole5(4H)thione
5(1benzofuran2yl)4phenyl2(piperidin1ylmethyl)124triazole3thione
5(1benzofuran2yl)4phenyl2(piperidin1ylmethyl)24dihydro3H124triazole3thione
C1CCN(CC1)CN2C(=S)N(C(=N2)C3=CC4=CC=CC=C4O3)C5=CC=CC=C5
InChI=1SC22H22N4OSc282225(1624137281424)2321(26(22)18103141118)2015179561219(17)2720h13691215H278131416H2
MFCD08744318
ZINC000009060873
ZINC9060873
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