5-phenyl-4-(piperidin-1-ylcarbonylamino)pentanethioate

Systemtic Name: 5-phenyl-4-(piperidin-1-ylcarbonylamino)pentanethioate Openeye Name: 5-phenyl-4-(piperidine-1-carbonylamino)pentanethioate CAS Name: 4-[[oxo(1-piperidinyl)methyl]amino]-5-phenylpentanethioate IUPAC Name: 5-phenyl-4-(piperidine-1-carbonylamino)pentanethioate Traditional Name: 5-phenyl-4-(piperidine-1-carbonylamino)thiovalerate Formula: C17H23N2O2S- MolecularWeight: 319.44172

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)NC(CCC(=S)[O-])CC2=CC=CC=C2

Isomeric SMILES

C1CCN(CC1)C(=O)NC(CCC(=S)[O-])CC2=CC=CC=C2

InChI

InChI=1S/C17H24N2O2S/c20-16(22)10-9-15(13-14-7-3-1-4-8-14)18-17(21)19-11-5-2-6-12-19/h1,3-4,7-8,15H,2,5-6,9-13H2,(H,18,21)(H,20,22)/p-1