2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]-N-(4-phenyl-1,3-thiazol-2-yl)ethanamide

Systemtic Name: 2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]-N-(4-phenyl-1,3-thiazol-2-yl)ethanamide Openeye Name: 2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]-N-(4-phenylthiazol-2-yl)acetamide CAS Name: 2-[4-(4-fluorophenyl)-1-piperazin-1-iumyl]-N-(4-phenyl-2-thiazolyl)acetamide IUPAC Name: 2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]-N-(4-phenyl-1,3-thiazol-2-yl)acetamide Traditional Name: 2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]-N-(4-phenylthiazol-2-yl)acetamide Formula: C21H22FN4OS+ MolecularWeight: 397.488983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=NC(=CS2)C3=CC=CC=C3)C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=NC(=CS2)C3=CC=CC=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H21FN4OS/c22-17-6-8-18(9-7-17)26-12-10-25(11-13-26)14-20(27)24-21-23-19(15-28-21)16-4-2-1-3-5-16/h1-9,15H,10-14H2,(H,23,24,27)/p+1