N-[8-(phenylmethylsulfanyl)quinolin-5-yl]ethanamide

Systemtic Name: N-[8-(phenylmethylsulfanyl)quinolin-5-yl]ethanamide Openeye Name: N-(8-benzylsulfanyl-5-quinolyl)acetamide CAS Name: N-[8-(phenylmethylthio)-5-quinolinyl]acetamide IUPAC Name: N-(8-benzylsulfanylquinolin-5-yl)acetamide Traditional Name: N-[8-(benzylthio)-5-quinolyl]acetamide Formula: C18H16N2OS MolecularWeight: 308.39744

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C2C=CC=NC2=C(C=C1)SCC3=CC=CC=C3

Isomeric SMILES

CC(=O)NC1=C2C=CC=NC2=C(C=C1)SCC3=CC=CC=C3

InChI

InChI=1S/C18H16N2OS/c1-13(21)20-16-9-10-17(18-15(16)8-5-11-19-18)22-12-14-6-3-2-4-7-14/h2-11H,12H2,1H3,(H,20,21)