N-hexyl-2-(phenylmethylsulfanyl)pyridine-3-carboxamide

Systemtic Name: N-hexyl-2-(phenylmethylsulfanyl)pyridine-3-carboxamide Openeye Name: 2-benzylsulfanyl-N-hexyl-pyridine-3-carboxamide CAS Name: N-hexyl-2-(phenylmethylthio)-3-pyridinecarboxamide IUPAC Name: 2-benzylsulfanyl-N-hexylpyridine-3-carboxamide Traditional Name: 2-(benzylthio)-N-hexyl-nicotinamide Formula: C19H24N2OS MolecularWeight: 328.47166

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)C1=C(N=CC=C1)SCC2=CC=CC=C2

Isomeric SMILES

CCCCCCNC(=O)C1=C(N=CC=C1)SCC2=CC=CC=C2

InChI

InChI=1S/C19H24N2OS/c1-2-3-4-8-13-20-18(22)17-12-9-14-21-19(17)23-15-16-10-6-5-7-11-16/h5-7,9-12,14H,2-4,8,13,15H2,1H3,(H,20,22)