4-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]butanethioamide

Systemtic Name: 4-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]butanethioamide Openeye Name: 4-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]butanethioamide CAS Name: 4-[(3S,5S)-3,5-dimethyl-1-piperidin-1-iumyl]butanethioamide IUPAC Name: 4-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]butanethioamide Traditional Name: 4-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]thiobutyramide Formula: C11H23N2S+ MolecularWeight: 215.37872

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C[NH+](C1)CCCC(=S)N)C

Isomeric SMILES

C[C@H]1C[C@@H](C[NH+](C1)CCCC(=S)N)C

InChI

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