4-[2-(2-hydroxyethyloxy)ethyl]-N-phenyl-piperazin-4-ium-1-carbothioamide

Systemtic Name: 4-[2-(2-hydroxyethyloxy)ethyl]-N-phenyl-piperazin-4-ium-1-carbothioamide Openeye Name: 4-[2-(2-hydroxyethoxy)ethyl]-N-phenyl-piperazin-4-ium-1-carbothioamide CAS Name: 4-[2-(2-hydroxyethoxy)ethyl]-N-phenyl-1-piperazin-4-iumcarbothioamide IUPAC Name: 4-[2-(2-hydroxyethoxy)ethyl]-N-phenylpiperazin-4-ium-1-carbothioamide Traditional Name: 4-[2-(2-hydroxyethoxy)ethyl]-N-phenyl-piperazin-4-ium-1-carbothioamide Formula: C15H24N3O2S+ MolecularWeight: 310.43496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H23N3O2S/c19-11-13-20-12-10-17-6-8-18(9-7-17)15(21)16-14-4-2-1-3-5-14/h1-5,19H,6-13H2,(H,16,21)/p+1