S-(1-azanyl-3-phenyl-propyl) 2-oxidanylidene-2-piperidin-1-yl-ethanethioate

Systemtic Name: S-(1-azanyl-3-phenyl-propyl) 2-oxidanylidene-2-piperidin-1-yl-ethanethioate Openeye Name: S-(1-amino-3-phenyl-propyl) 2-oxo-2-(1-piperidyl)ethanethioate CAS Name: 2-oxo-2-(1-piperidinyl)ethanethioic acid S-(1-amino-3-phenylpropyl) ester IUPAC Name: S-(1-amino-3-phenylpropyl) 2-oxo-2-piperidin-1-ylethanethioate Traditional Name: 2-keto-2-piperidino-ethanethioic acid S-(1-amino-3-phenyl-propyl) ester Formula: C16H22N2O2S MolecularWeight: 306.42308

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C(=O)SC(CCC2=CC=CC=C2)N

Isomeric SMILES

C1CCN(CC1)C(=O)C(=O)SC(CCC2=CC=CC=C2)N

InChI

InChI=1S/C16H22N2O2S/c17-14(10-9-13-7-3-1-4-8-13)21-16(20)15(19)18-11-5-2-6-12-18/h1,3-4,7-8,14H,2,5-6,9-12,17H2