4-[(3S)-3-methylpiperidin-1-ium-1-yl]butanethioamide

Systemtic Name: 4-[(3S)-3-methylpiperidin-1-ium-1-yl]butanethioamide Openeye Name: 4-[(3S)-3-methylpiperidin-1-ium-1-yl]butanethioamide CAS Name: 4-[(3S)-3-methyl-1-piperidin-1-iumyl]butanethioamide IUPAC Name: 4-[(3S)-3-methylpiperidin-1-ium-1-yl]butanethioamide Traditional Name: 4-[(3S)-3-methylpiperidin-1-ium-1-yl]thiobutyramide Formula: C10H21N2S+ MolecularWeight: 201.35214

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CCCC(=S)N

Isomeric SMILES

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

InChI

InChI=1S/C10H20N2S/c1-9-4-2-6-12(8-9)7-3-5-10(11)13/h9H,2-8H2,1H3,(H2,11,13)/p+1/t9-/m0/s1