N-[3-(phenylmethylsulfanyl)propyl]-1-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide

Systemtic Name: N-[3-(phenylmethylsulfanyl)propyl]-1-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide Openeye Name: N-(3-benzylsulfanylpropyl)-1-[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl]piperidine-3-carboxamide CAS Name: N-[3-(phenylmethylthio)propyl]-1-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]-3-piperidinecarboxamide IUPAC Name: N-(3-benzylsulfanylpropyl)-1-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide Traditional Name: N-[3-(benzylthio)propyl]-1-[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl]nipecotamide Formula: C23H28N4O2S2 MolecularWeight: 456.62402

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=NC(=NO2)C3=CC=CS3)C(=O)NCCCSCC4=CC=CC=C4

Isomeric SMILES

C1CC(CN(C1)CC2=NC(=NO2)C3=CC=CS3)C(=O)NCCCSCC4=CC=CC=C4

InChI

InChI=1S/C23H28N4O2S2/c28-23(24-11-6-13-30-17-18-7-2-1-3-8-18)19-9-4-12-27(15-19)16-21-25-22(26-29-21)20-10-5-14-31-20/h1-3,5,7-8,10,14,19H,4,6,9,11-13,15-17H2,(H,24,28)