4-[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]butanethioamide

Systemtic Name: 4-[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]butanethioamide Openeye Name: 4-[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]butanethioamide CAS Name: 4-[(2S,6S)-2,6-dimethyl-1-piperidin-1-iumyl]butanethioamide IUPAC Name: 4-[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]butanethioamide Traditional Name: 4-[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]thiobutyramide Formula: C11H23N2S+ MolecularWeight: 215.37872

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC([NH+]1CCCC(=S)N)C

Isomeric SMILES

C[C@H]1CCC[C@@H]([NH+]1CCCC(=S)N)C

InChI

InChI=1S/C11H22N2S/c1-9-5-3-6-10(2)13(9)8-4-7-11(12)14/h9-10H,3-8H2,1-2H3,(H2,12,14)/p+1/t9-,10-/m0/s1