4-phenethyl-N-propyl-piperazin-4-ium-1-carbothioamide

Systemtic Name: 4-phenethyl-N-propyl-piperazin-4-ium-1-carbothioamide Openeye Name: 4-phenethyl-N-propyl-piperazin-4-ium-1-carbothioamide CAS Name: 4-phenethyl-N-propyl-1-piperazin-4-iumcarbothioamide IUPAC Name: 4-phenethyl-N-propylpiperazin-4-ium-1-carbothioamide Traditional Name: 4-phenethyl-N-propyl-piperazin-4-ium-1-carbothioamide Formula: C16H26N3S+ MolecularWeight: 292.46274

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=S)N1CC[NH+](CC1)CCC2=CC=CC=C2

Isomeric SMILES

CCCNC(=S)N1CC[NH+](CC1)CCC2=CC=CC=C2

InChI

InChI=1S/C16H25N3S/c1-2-9-17-16(20)19-13-11-18(12-14-19)10-8-15-6-4-3-5-7-15/h3-7H,2,8-14H2,1H3,(H,17,20)/p+1