methyl 4-[(1S)-3-azanyl-1-ethanoylsulfanyl-3-oxidanylidene-propyl]piperidine-1-carboxylate

Systemtic Name: methyl 4-[(1S)-3-azanyl-1-ethanoylsulfanyl-3-oxidanylidene-propyl]piperidine-1-carboxylate Openeye Name: methyl 4-[(1S)-1-acetylsulfanyl-3-amino-3-oxo-propyl]piperidine-1-carboxylate CAS Name: 4-[(1S)-1-(acetylthio)-3-amino-3-oxopropyl]-1-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 4-[(1S)-1-acetylsulfanyl-3-amino-3-oxopropyl]piperidine-1-carboxylate Traditional Name: 4-[(1S)-1-(acetylthio)-3-amino-3-keto-propyl]piperidine-1-carboxylic acid methyl ester Formula: C12H20N2O4S MolecularWeight: 288.3632

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC(CC(=O)N)C1CCN(CC1)C(=O)OC

Isomeric SMILES

CC(=O)S[C@@H](CC(=O)N)C1CCN(CC1)C(=O)OC

InChI

InChI=1S/C12H20N2O4S/c1-8(15)19-10(7-11(13)16)9-3-5-14(6-4-9)12(17)18-2/h9-10H,3-7H2,1-2H3,(H2,13,16)/t10-/m0/s1