N-[(1R,2R)-1-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]-1-thiophen-2-yl-propan-2-yl]cyclohexanecarboxamide

Systemtic Name: N-[(1R,2R)-1-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]-1-thiophen-2-yl-propan-2-yl]cyclohexanecarboxamide Openeye Name: N-[(1R,2R)-2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]-1-methyl-2-(2-thienyl)ethyl]cyclohexanecarboxamide CAS Name: N-[(1R,2R)-1-[4-(2-fluorophenyl)-1-piperazin-1-iumyl]-1-thiophen-2-ylpropan-2-yl]cyclohexanecarboxamide IUPAC Name: N-[(1R,2R)-1-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]-1-thiophen-2-ylpropan-2-yl]cyclohexanecarboxamide Traditional Name: N-[(1R,2R)-2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]-1-methyl-2-(2-thienyl)ethyl]cyclohexanecarboxamide Formula: C24H33FN3OS+ MolecularWeight: 430.601723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CS1)[NH+]2CCN(CC2)C3=CC=CC=C3F)NC(=O)C4CCCCC4

Isomeric SMILES

C[C@H]([C@H](C1=CC=CS1)[NH+]2CCN(CC2)C3=CC=CC=C3F)NC(=O)C4CCCCC4

InChI

InChI=1S/C24H32FN3OS/c1-18(26-24(29)19-8-3-2-4-9-19)23(22-12-7-17-30-22)28-15-13-27(14-16-28)21-11-6-5-10-20(21)25/h5-7,10-12,17-19,23H,2-4,8-9,13-16H2,1H3,(H,26,29)/p+1/t18-,23-/m1/s1