N-(4-fluorophenyl)-4-(2-hydroxyethyl)piperazin-4-ium-1-carbothioamide

Systemtic Name: N-(4-fluorophenyl)-4-(2-hydroxyethyl)piperazin-4-ium-1-carbothioamide Openeye Name: N-(4-fluorophenyl)-4-(2-hydroxyethyl)piperazin-4-ium-1-carbothioamide CAS Name: N-(4-fluorophenyl)-4-(2-hydroxyethyl)-1-piperazin-4-iumcarbothioamide IUPAC Name: N-(4-fluorophenyl)-4-(2-hydroxyethyl)piperazin-4-ium-1-carbothioamide Traditional Name: N-(4-fluorophenyl)-4-(2-hydroxyethyl)piperazin-4-ium-1-carbothioamide Formula: C13H19FN3OS+ MolecularWeight: 284.372863

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCO)C(=S)NC2=CC=C(C=C2)F

Isomeric SMILES

C1CN(CC[NH+]1CCO)C(=S)NC2=CC=C(C=C2)F

InChI

InChI=1S/C13H18FN3OS/c14-11-1-3-12(4-2-11)15-13(19)17-7-5-16(6-8-17)9-10-18/h1-4,18H,5-10H2,(H,15,19)/p+1