Vitas-M small molecule compound
4-cyclohexyl-5-(6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STK449918
SMILES CC1CCc2c(C1)scc2c1nnc(n1C1CCCCC1)S
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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 C17H23N3S2 MW 333.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H23N3S2/c1-11-7-8-13-14(10-22-15(13)9-11)16-18-19-17(21)20(16)12-5-3-2-4-6-12/h10-12H,2-9H2,1H3,(H,19,21)InChIKey
HVSARAWVVQSSLW-UHFFFAOYSA-NSynonyms
4cyclohexyl3(6methyl4567tetrahydro1benzothiophen3yl)1H124triazole5thione
4cyclohexyl5(6methyl4567tetrahydro1benzothiophen3yl)4H124triazole3thiol
CC1CCC2=C(C1)SC=C2C3=NNC(=S)N3C4CCCCC4
InChI=1SC17H23N3S2c111781314(102215(13)911)16181917(21)20(16)125324612h1012H29H21H3(H1921)
MFCD03467973
ZINC000006175685
ZINC000006199882
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