4-[(4-phenylpiperazin-1-ium-1-yl)methyl]-2-[4-(trifluoromethyl)phenyl]-1,3-thiazole

Systemtic Name: 4-[(4-phenylpiperazin-1-ium-1-yl)methyl]-2-[4-(trifluoromethyl)phenyl]-1,3-thiazole Openeye Name: 4-[(4-phenylpiperazin-1-ium-1-yl)methyl]-2-[4-(trifluoromethyl)phenyl]thiazole CAS Name: 4-[(4-phenyl-1-piperazin-1-iumyl)methyl]-2-[4-(trifluoromethyl)phenyl]thiazole IUPAC Name: 4-[(4-phenylpiperazin-1-ium-1-yl)methyl]-2-[4-(trifluoromethyl)phenyl]-1,3-thiazole Traditional Name: 4-[(4-phenylpiperazin-1-ium-1-yl)methyl]-2-[4-(trifluoromethyl)phenyl]thiazole Formula: C21H21F3N3S+ MolecularWeight: 404.47175

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20F3N3S/c22-21(23,24)17-8-6-16(7-9-17)20-25-18(15-28-20)14-26-10-12-27(13-11-26)19-4-2-1-3-5-19/h1-9,15H,10-14H2/p+1