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

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

CN(CCCSC1=CC2=C(C=C1)C=C(C=C2)Cl)C(=O)C3CCN(CC3)C4=CC=NC=C4

Isomeric SMILES

CN(CCCSC1=CC2=C(C=C1)C=C(C=C2)Cl)C(=O)C3CCN(CC3)C4=CC=NC=C4

InChI

InChI=1S/C25H28ClN3OS/c1-28(25(30)19-9-14-29(15-10-19)23-7-11-27-12-8-23)13-2-16-31-24-6-4-20-17-22(26)5-3-21(20)18-24/h3-8,11-12,17-19H,2,9-10,13-16H2,1H3