N,N-dimethyl-2-[4-(phenethylcarbamothioyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N,N-dimethyl-2-[4-(phenethylcarbamothioyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N,N-dimethyl-2-[4-(phenethylcarbamothioyl)piperazin-1-ium-1-yl]acetamide CAS Name: N,N-dimethyl-2-[4-[(phenethylamino)-sulfanylidenemethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N,N-dimethyl-2-[4-(phenethylcarbamothioyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N,N-dimethyl-2-[4-(phenethylthiocarbamoyl)piperazin-1-ium-1-yl]acetamide Formula: C17H27N4OS+ MolecularWeight: 335.48748

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C[NH+]1CCN(CC1)C(=S)NCCC2=CC=CC=C2

Isomeric SMILES

CN(C)C(=O)C[NH+]1CCN(CC1)C(=S)NCCC2=CC=CC=C2

InChI

InChI=1S/C17H26N4OS/c1-19(2)16(22)14-20-10-12-21(13-11-20)17(23)18-9-8-15-6-4-3-5-7-15/h3-7H,8-14H2,1-2H3,(H,18,23)/p+1