2-(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-1-[4-(phenylsulfonyl)piperazin-1-yl]ethanone

Systemtic Name: 2-(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-1-[4-(phenylsulfonyl)piperazin-1-yl]ethanone Openeye Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-2-(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-ethanone CAS Name: 1-[4-(benzenesulfonyl)-1-piperazinyl]-2-[(1-cyclohexyl-4,5-dimethyl-2-imidazolyl)thio]ethanone IUPAC Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-2-(1-cyclohexyl-4,5-dimethylimidazol-2-yl)sulfanylethanone Traditional Name: 1-(4-besylpiperazino)-2-[(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)thio]ethanone Formula: C23H32N4O3S2 MolecularWeight: 476.65518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=N1)SCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)C4CCCCC4)C

Isomeric SMILES

CC1=C(N(C(=N1)SCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)C4CCCCC4)C

InChI

InChI=1S/C23H32N4O3S2/c1-18-19(2)27(20-9-5-3-6-10-20)23(24-18)31-17-22(28)25-13-15-26(16-14-25)32(29,30)21-11-7-4-8-12-21/h4,7-8,11-12,20H,3,5-6,9-10,13-17H2,1-2H3