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

Systemtic Name: 4-ethyl-N-methyl-piperazin-4-ium-1-carbothioamide Openeye Name: 4-ethyl-N-methyl-piperazin-4-ium-1-carbothioamide CAS Name: 4-ethyl-N-methyl-1-piperazin-4-iumcarbothioamide IUPAC Name: 4-ethyl-N-methylpiperazin-4-ium-1-carbothioamide Traditional Name: 4-ethyl-N-methyl-piperazin-4-ium-1-carbothioamide Formula: C8H18N3S+ MolecularWeight: 188.31362

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=S)NC

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=S)NC

InChI

InChI=1S/C8H17N3S/c1-3-10-4-6-11(7-5-10)8(12)9-2/h3-7H2,1-2H3,(H,9,12)/p+1