2-pentylsulfanyl-N-phenethyl-pyridine-3-carboxamide

Systemtic Name: 2-pentylsulfanyl-N-phenethyl-pyridine-3-carboxamide Openeye Name: 2-pentylsulfanyl-N-phenethyl-pyridine-3-carboxamide CAS Name: 2-(pentylthio)-N-phenethyl-3-pyridinecarboxamide IUPAC Name: 2-pentylsulfanyl-N-phenethylpyridine-3-carboxamide Traditional Name: 2-(amylthio)-N-phenethyl-nicotinamide Formula: C19H24N2OS MolecularWeight: 328.47166

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSC1=C(C=CC=N1)C(=O)NCCC2=CC=CC=C2

Isomeric SMILES

CCCCCSC1=C(C=CC=N1)C(=O)NCCC2=CC=CC=C2

InChI

InChI=1S/C19H24N2OS/c1-2-3-7-15-23-19-17(11-8-13-21-19)18(22)20-14-12-16-9-5-4-6-10-16/h4-6,8-11,13H,2-3,7,12,14-15H2,1H3,(H,20,22)