2-[3-(6-chloranylnaphthalen-2-yl)sulfanylpropyl]-N-methyl-1-pyridin-4-yl-piperidine-4-carboxamide

Systemtic Name: 2-[3-(6-chloranylnaphthalen-2-yl)sulfanylpropyl]-N-methyl-1-pyridin-4-yl-piperidine-4-carboxamide Openeye Name: 2-[3-[(6-chloro-2-naphthyl)sulfanyl]propyl]-N-methyl-1-(4-pyridyl)piperidine-4-carboxamide CAS Name: 2-[3-[(6-chloro-2-naphthalenyl)thio]propyl]-N-methyl-1-pyridin-4-yl-4-piperidinecarboxamide IUPAC Name: 2-[3-(6-chloronaphthalen-2-yl)sulfanylpropyl]-N-methyl-1-pyridin-4-ylpiperidine-4-carboxamide Traditional Name: 2-[3-[(6-chloro-2-naphthyl)thio]propyl]-N-methyl-1-(4-pyridyl)isonipecotamide Formula: C25H28ClN3OS MolecularWeight: 454.02732

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1CCN(C(C1)CCCSC2=CC3=C(C=C2)C=C(C=C3)Cl)C4=CC=NC=C4

Isomeric SMILES

CNC(=O)C1CCN(C(C1)CCCSC2=CC3=C(C=C2)C=C(C=C3)Cl)C4=CC=NC=C4

InChI

InChI=1S/C25H28ClN3OS/c1-27-25(30)20-10-13-29(22-8-11-28-12-9-22)23(16-20)3-2-14-31-24-7-5-18-15-21(26)6-4-19(18)17-24/h4-9,11-12,15,17,20,23H,2-3,10,13-14,16H2,1H3,(H,27,30)