4-(4-methylpiperazin-4-ium-1-yl)butanethioamide

Systemtic Name: 4-(4-methylpiperazin-4-ium-1-yl)butanethioamide Openeye Name: 4-(4-methylpiperazin-4-ium-1-yl)butanethioamide CAS Name: 4-(4-methyl-1-piperazin-4-iumyl)butanethioamide IUPAC Name: 4-(4-methylpiperazin-4-ium-1-yl)butanethioamide Traditional Name: 4-(4-methylpiperazin-4-ium-1-yl)thiobutyramide Formula: C9H20N3S+ MolecularWeight: 202.3402

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CCCC(=S)N

Isomeric SMILES

C[NH+]1CCN(CC1)CCCC(=S)N

InChI

InChI=1S/C9H19N3S/c1-11-5-7-12(8-6-11)4-2-3-9(10)13/h2-8H2,1H3,(H2,10,13)/p+1