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

Systemtic Name: N-(2-fluorophenyl)-N-[4-[(3-oxidanylidenepiperazin-1-ium-1-yl)methyl]-1,3-thiazol-2-yl]ethanamide Openeye Name: N-(2-fluorophenyl)-N-[4-[(3-oxopiperazin-1-ium-1-yl)methyl]thiazol-2-yl]acetamide CAS Name: N-(2-fluorophenyl)-N-[4-[(3-oxo-1-piperazin-1-iumyl)methyl]-2-thiazolyl]acetamide IUPAC Name: N-(2-fluorophenyl)-N-[4-[(3-oxopiperazin-1-ium-1-yl)methyl]-1,3-thiazol-2-yl]acetamide Traditional Name: N-(2-fluorophenyl)-N-[4-[(3-ketopiperazin-1-ium-1-yl)methyl]thiazol-2-yl]acetamide Formula: C16H18FN4O2S+ MolecularWeight: 349.403123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C1=CC=CC=C1F)C2=NC(=CS2)C[NH+]3CCNC(=O)C3

Isomeric SMILES

CC(=O)N(C1=CC=CC=C1F)C2=NC(=CS2)C[NH+]3CCNC(=O)C3

InChI

InChI=1S/C16H17FN4O2S/c1-11(22)21(14-5-3-2-4-13(14)17)16-19-12(10-24-16)8-20-7-6-18-15(23)9-20/h2-5,10H,6-9H2,1H3,(H,18,23)/p+1