N-butyl-4-ethyl-piperazin-4-ium-1-carbothioamide

Systemtic Name: N-butyl-4-ethyl-piperazin-4-ium-1-carbothioamide Openeye Name: N-butyl-4-ethyl-piperazin-4-ium-1-carbothioamide CAS Name: N-butyl-4-ethyl-1-piperazin-4-iumcarbothioamide IUPAC Name: N-butyl-4-ethylpiperazin-4-ium-1-carbothioamide Traditional Name: N-butyl-4-ethyl-piperazin-4-ium-1-carbothioamide Formula: C11H24N3S+ MolecularWeight: 230.39336

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)N1CC[NH+](CC1)CC

Isomeric SMILES

CCCCNC(=S)N1CC[NH+](CC1)CC

InChI

InChI=1S/C11H23N3S/c1-3-5-6-12-11(15)14-9-7-13(4-2)8-10-14/h3-10H2,1-2H3,(H,12,15)/p+1