N-butyl-4-[2-(butylcarbamothioylamino)ethyl]piperazin-4-ium-1-carbothioamide

Systemtic Name: N-butyl-4-[2-(butylcarbamothioylamino)ethyl]piperazin-4-ium-1-carbothioamide Openeye Name: N-butyl-4-[2-(butylcarbamothioylamino)ethyl]piperazin-4-ium-1-carbothioamide CAS Name: N-butyl-4-[2-[[butylamino(sulfanylidene)methyl]amino]ethyl]-1-piperazin-4-iumcarbothioamide IUPAC Name: N-butyl-4-[2-(butylcarbamothioylamino)ethyl]piperazin-4-ium-1-carbothioamide Traditional Name: N-butyl-4-[2-(butylthiocarbamoylamino)ethyl]piperazin-4-ium-1-carbothioamide Formula: C16H34N5S2+ MolecularWeight: 360.60466

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NCC[NH+]1CCN(CC1)C(=S)NCCCC

Isomeric SMILES

CCCCNC(=S)NCC[NH+]1CCN(CC1)C(=S)NCCCC

InChI

InChI=1S/C16H33N5S2/c1-3-5-7-17-15(22)18-9-10-20-11-13-21(14-12-20)16(23)19-8-6-4-2/h3-14H2,1-2H3,(H,19,23)(H2,17,18,22)/p+1