N-[3-(2-methylpiperidin-1-yl)propyl]-2-pentylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-[3-(2-methylpiperidin-1-yl)propyl]-2-pentylsulfanyl-pyridine-3-carboxamide Openeye Name: N-[3-(2-methyl-1-piperidyl)propyl]-2-pentylsulfanyl-pyridine-3-carboxamide CAS Name: N-[3-(2-methyl-1-piperidinyl)propyl]-2-(pentylthio)-3-pyridinecarboxamide IUPAC Name: N-[3-(2-methylpiperidin-1-yl)propyl]-2-pentylsulfanylpyridine-3-carboxamide Traditional Name: 2-(amylthio)-N-[3-(2-methylpiperidino)propyl]nicotinamide Formula: C20H33N3OS MolecularWeight: 363.56052

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSC1=C(C=CC=N1)C(=O)NCCCN2CCCCC2C

Isomeric SMILES

CCCCCSC1=C(C=CC=N1)C(=O)NCCCN2CCCCC2C

InChI

InChI=1S/C20H33N3OS/c1-3-4-7-16-25-20-18(11-8-12-22-20)19(24)21-13-9-15-23-14-6-5-10-17(23)2/h8,11-12,17H,3-7,9-10,13-16H2,1-2H3,(H,21,24)