1-(1,3-benzoxazol-2-yl)-N-[2-(phenylmethylsulfanyl)ethyl]piperidine-4-carboxamide

Systemtic Name: 1-(1,3-benzoxazol-2-yl)-N-[2-(phenylmethylsulfanyl)ethyl]piperidine-4-carboxamide Openeye Name: 1-(1,3-benzoxazol-2-yl)-N-(2-benzylsulfanylethyl)piperidine-4-carboxamide CAS Name: 1-(1,3-benzoxazol-2-yl)-N-[2-(phenylmethylthio)ethyl]-4-piperidinecarboxamide IUPAC Name: 1-(1,3-benzoxazol-2-yl)-N-(2-benzylsulfanylethyl)piperidine-4-carboxamide Traditional Name: 1-(1,3-benzoxazol-2-yl)-N-[2-(benzylthio)ethyl]isonipecotamide Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCCSCC2=CC=CC=C2)C3=NC4=CC=CC=C4O3

Isomeric SMILES

C1CN(CCC1C(=O)NCCSCC2=CC=CC=C2)C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C22H25N3O2S/c26-21(23-12-15-28-16-17-6-2-1-3-7-17)18-10-13-25(14-11-18)22-24-19-8-4-5-9-20(19)27-22/h1-9,18H,10-16H2,(H,23,26)