1-[4-(1-adamantyl)piperazin-1-yl]-2-[[5-methyl-4-(2-methylsulfanylethyl)-1H-imidazol-2-yl]sulfanyl]ethanone

Systemtic Name: 1-[4-(1-adamantyl)piperazin-1-yl]-2-[[5-methyl-4-(2-methylsulfanylethyl)-1H-imidazol-2-yl]sulfanyl]ethanone Openeye Name: 1-[4-(1-adamantyl)piperazin-1-yl]-2-[[5-methyl-4-(2-methylsulfanylethyl)-1H-imidazol-2-yl]sulfanyl]ethanone CAS Name: 1-[4-(1-adamantyl)-1-piperazinyl]-2-[[5-methyl-4-[2-(methylthio)ethyl]-1H-imidazol-2-yl]thio]ethanone IUPAC Name: 1-[4-(1-adamantyl)piperazin-1-yl]-2-[[5-methyl-4-(2-methylsulfanylethyl)-1H-imidazol-2-yl]sulfanyl]ethanone Traditional Name: 1-[4-(1-adamantyl)piperazino]-2-[[5-methyl-4-[2-(methylthio)ethyl]-1H-imidazol-2-yl]thio]ethanone Formula: C23H36N4OS2 MolecularWeight: 448.68814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N1)SCC(=O)N2CCN(CC2)C34CC5CC(C3)CC(C5)C4)CCSC

Isomeric SMILES

CC1=C(N=C(N1)SCC(=O)N2CCN(CC2)C34CC5CC(C3)CC(C5)C4)CCSC

InChI

InChI=1S/C23H36N4OS2/c1-16-20(3-8-29-2)25-22(24-16)30-15-21(28)26-4-6-27(7-5-26)23-12-17-9-18(13-23)11-19(10-17)14-23/h17-19H,3-15H2,1-2H3,(H,24,25)