N-[2-(4-chlorophenyl)sulfanylethyl]-1-pyridin-3-ylcarbonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-(4-chlorophenyl)sulfanylethyl]-1-pyridin-3-ylcarbonyl-piperidine-4-carboxamide Openeye Name: N-[2-(4-chlorophenyl)sulfanylethyl]-1-(pyridine-3-carbonyl)piperidine-4-carboxamide CAS Name: N-[2-[(4-chlorophenyl)thio]ethyl]-1-[oxo(3-pyridinyl)methyl]-4-piperidinecarboxamide IUPAC Name: N-[2-(4-chlorophenyl)sulfanylethyl]-1-(pyridine-3-carbonyl)piperidine-4-carboxamide Traditional Name: N-[2-[(4-chlorophenyl)thio]ethyl]-1-nicotinoyl-isonipecotamide Formula: C20H22ClN3O2S MolecularWeight: 403.92558

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCCSC2=CC=C(C=C2)Cl)C(=O)C3=CN=CC=C3

Isomeric SMILES

C1CN(CCC1C(=O)NCCSC2=CC=C(C=C2)Cl)C(=O)C3=CN=CC=C3

InChI

InChI=1S/C20H22ClN3O2S/c21-17-3-5-18(6-4-17)27-13-10-23-19(25)15-7-11-24(12-8-15)20(26)16-2-1-9-22-14-16/h1-6,9,14-15H,7-8,10-13H2,(H,23,25)