N3-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-N1-phenyl-piperidine-1,3-dicarboxamide

Systemtic Name: N3-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-N1-phenyl-piperidine-1,3-dicarboxamide Openeye Name: N3-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-N1-phenyl-piperidine-1,3-dicarboxamide CAS Name: N3-[2-[(2-cyanophenyl)methylthio]ethyl]-N1-phenylpiperidine-1,3-dicarboxamide IUPAC Name: 3-N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-1-N-phenylpiperidine-1,3-dicarboxamide Traditional Name: N'-[2-[(2-cyanobenzyl)thio]ethyl]-N-phenyl-piperidine-1,3-dicarboxamide Formula: C23H26N4O2S MolecularWeight: 422.54314

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)NC2=CC=CC=C2)C(=O)NCCSCC3=CC=CC=C3C#N

Isomeric SMILES

C1CC(CN(C1)C(=O)NC2=CC=CC=C2)C(=O)NCCSCC3=CC=CC=C3C#N

InChI

InChI=1S/C23H26N4O2S/c24-15-18-7-4-5-8-20(18)17-30-14-12-25-22(28)19-9-6-13-27(16-19)23(29)26-21-10-2-1-3-11-21/h1-5,7-8,10-11,19H,6,9,12-14,16-17H2,(H,25,28)(H,26,29)