Vitas-M small molecule compound
5-(3-methoxyphenyl)-4-methyl-2-({4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STK663523
SMILES COc1cccc(c1)c1nn(c(=S)n1C)CN1CCN(CC1)c1cccc(c1)C(F)(F)F
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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 C22H24F3N5OS MW 463.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24F3N5OS/c1-27-20(16-5-3-8-19(13-16)31-2)26-30(21(27)32)15-28-9-11-29(12-10-28)18-7-4-6-17(14-18)22(23,24)25/h3-8,13-14H,9-12,15H2,1-2H3InChIKey
SZOSVWKQHCAYER-UHFFFAOYSA-NSynonyms
312279-32-63(3METHOXYPHENYL)4METHYL1((4(3(TRIFLUOROMETHYL)PHENYL)PIPERAZINYL)METHYL)124TRIAZOLINE5THIONE
312279326
5(3METHOXYPHENYL)4METHYL2((4(3(TRIFLUOROMETHYL)PHENYL)PIPERAZIN1YL)METHYL)124TRIAZOLE3THIONE
5(3methoxyphenyl)4methyl2((4(3(trifluoromethyl)phenyl)piperazin1yl)methyl)24dihydro3H124triazole3thione
CN1C(=NN(C1=S)CN2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F)C4=CC(=CC=C4)OC
InChI=1SC22H24F3N5OSc12720(1653819(1316)312)2630(21(27)32)152891129(121028)1874617(1418)22(2324)25h381314H91215H212H3
MFCD01304914
ZINC000055044009
ZINC55044009
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