S-pent-4-ynyl 2-(2-oxidanylidenepiperidin-3-yl)ethanethioate

Systemtic Name: S-pent-4-ynyl 2-(2-oxidanylidenepiperidin-3-yl)ethanethioate Openeye Name: S-pent-4-ynyl 2-(2-oxo-3-piperidyl)ethanethioate CAS Name: 2-(2-oxo-3-piperidinyl)ethanethioic acid S-pent-4-ynyl ester IUPAC Name: S-pent-4-ynyl 2-(2-oxopiperidin-3-yl)ethanethioate Traditional Name: 2-(2-keto-3-piperidyl)ethanethioic acid S-pent-4-ynyl ester Formula: C12H17NO2S MolecularWeight: 239.33388

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Descriptors Computed from Structure

Canonical SMILES:

C#CCCCSC(=O)CC1CCCNC1=O

Isomeric SMILES

C#CCCCSC(=O)CC1CCCNC1=O

InChI

InChI=1S/C12H17NO2S/c1-2-3-4-8-16-11(14)9-10-6-5-7-13-12(10)15/h1,10H,3-9H2,(H,13,15)