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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCCCSCC2=CC=CC=C2)CC3=NC(=NO3)C4=CC=CS4

Isomeric SMILES

C1CN(CCC1C(=O)NCCCSCC2=CC=CC=C2)CC3=NC(=NO3)C4=CC=CS4

InChI

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