4-fluoranyl-N-[2-oxidanylidene-2-[4-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperazin-4-ium-1-yl]ethyl]benzamide

Systemtic Name: 4-fluoranyl-N-[2-oxidanylidene-2-[4-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperazin-4-ium-1-yl]ethyl]benzamide Openeye Name: 4-fluoro-N-[2-oxo-2-[4-[(2-phenylthiazol-4-yl)methyl]piperazin-4-ium-1-yl]ethyl]benzamide CAS Name: 4-fluoro-N-[2-oxo-2-[4-[(2-phenyl-4-thiazolyl)methyl]-1-piperazin-4-iumyl]ethyl]benzamide IUPAC Name: 4-fluoro-N-[2-oxo-2-[4-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperazin-4-ium-1-yl]ethyl]benzamide Traditional Name: 4-fluoro-N-[2-keto-2-[4-[(2-phenylthiazol-4-yl)methyl]piperazin-4-ium-1-yl]ethyl]benzamide Formula: C23H24FN4O2S+ MolecularWeight: 439.525663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CSC(=N2)C3=CC=CC=C3)C(=O)CNC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CC[NH+]1CC2=CSC(=N2)C3=CC=CC=C3)C(=O)CNC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H23FN4O2S/c24-19-8-6-17(7-9-19)22(30)25-14-21(29)28-12-10-27(11-13-28)15-20-16-31-23(26-20)18-4-2-1-3-5-18/h1-9,16H,10-15H2,(H,25,30)/p+1