2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-[(1-morpholin-4-ylcyclohexyl)methyl]ethanamide

Systemtic Name: 2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-[(1-morpholin-4-ylcyclohexyl)methyl]ethanamide Openeye Name: 2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-[(1-morpholinocyclohexyl)methyl]acetamide CAS Name: 2-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazin-1-iumyl]-N-[[1-(4-morpholinyl)cyclohexyl]methyl]acetamide IUPAC Name: 2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-[(1-morpholin-4-ylcyclohexyl)methyl]acetamide Traditional Name: 2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-[(1-morpholinocyclohexyl)methyl]acetamide Formula: C25H41N4O4S+ MolecularWeight: 493.68244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NCC3(CCCCC3)N4CCOCC4

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NCC3(CCCCC3)N4CCOCC4

InChI

InChI=1S/C25H40N4O4S/c1-21-6-7-22(2)23(18-21)34(31,32)29-12-10-27(11-13-29)19-24(30)26-20-25(8-4-3-5-9-25)28-14-16-33-17-15-28/h6-7,18H,3-5,8-17,19-20H2,1-2H3,(H,26,30)/p+1