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

Systemtic Name: N-ethyl-4-[2-(ethylcarbamothioylamino)ethyl]piperazin-4-ium-1-carbothioamide Openeye Name: N-ethyl-4-[2-(ethylcarbamothioylamino)ethyl]piperazin-4-ium-1-carbothioamide CAS Name: N-ethyl-4-[2-[[ethylamino(sulfanylidene)methyl]amino]ethyl]-1-piperazin-4-iumcarbothioamide IUPAC Name: N-ethyl-4-[2-(ethylcarbamothioylamino)ethyl]piperazin-4-ium-1-carbothioamide Traditional Name: N-ethyl-4-[2-(ethylthiocarbamoylamino)ethyl]piperazin-4-ium-1-carbothioamide Formula: C12H26N5S2+ MolecularWeight: 304.49834

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H25N5S2/c1-3-13-11(18)15-5-6-16-7-9-17(10-8-16)12(19)14-4-2/h3-10H2,1-2H3,(H,14,19)(H2,13,15,18)/p+1