4-(2-cyanoethyl)piperazin-4-ium-1-carbothioamide

Systemtic Name: 4-(2-cyanoethyl)piperazin-4-ium-1-carbothioamide Openeye Name: 4-(2-cyanoethyl)piperazin-4-ium-1-carbothioamide CAS Name: 4-(2-cyanoethyl)-1-piperazin-4-iumcarbothioamide IUPAC Name: 4-(2-cyanoethyl)piperazin-4-ium-1-carbothioamide Traditional Name: 4-(2-cyanoethyl)piperazin-4-ium-1-carbothioamide Formula: C8H15N4S+ MolecularWeight: 199.2965

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCC#N)C(=S)N

Isomeric SMILES

C1CN(CC[NH+]1CCC#N)C(=S)N

InChI

InChI=1S/C8H14N4S/c9-2-1-3-11-4-6-12(7-5-11)8(10)13/h1,3-7H2,(H2,10,13)/p+1