N-(phenylmethyl)-1-[2-[phenyl(thian-4-yl)amino]ethyl]piperidine-4-carboxamide

Systemtic Name: N-(phenylmethyl)-1-[2-[phenyl(thian-4-yl)amino]ethyl]piperidine-4-carboxamide Openeye Name: N-benzyl-1-[2-(N-tetrahydrothiopyran-4-ylanilino)ethyl]piperidine-4-carboxamide CAS Name: N-(phenylmethyl)-1-[2-[N-(4-thianyl)anilino]ethyl]-4-piperidinecarboxamide IUPAC Name: N-benzyl-1-[2-[N-(thian-4-yl)anilino]ethyl]piperidine-4-carboxamide Traditional Name: N-benzyl-1-[2-(N-tetrahydrothiopyran-4-ylanilino)ethyl]isonipecotamide Formula: C26H35N3OS MolecularWeight: 437.6406

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2=CC=CC=C2)CCN(C3CCSCC3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)NCC2=CC=CC=C2)CCN(C3CCSCC3)C4=CC=CC=C4

InChI

InChI=1S/C26H35N3OS/c30-26(27-21-22-7-3-1-4-8-22)23-11-15-28(16-12-23)17-18-29(24-9-5-2-6-10-24)25-13-19-31-20-14-25/h1-10,23,25H,11-21H2,(H,27,30)