2-methyl-N-[2-(phenylmethylsulfanyl)ethyl]quinoline-4-carboxamide

Systemtic Name: 2-methyl-N-[2-(phenylmethylsulfanyl)ethyl]quinoline-4-carboxamide Openeye Name: N-(2-benzylsulfanylethyl)-2-methyl-quinoline-4-carboxamide CAS Name: 2-methyl-N-[2-(phenylmethylthio)ethyl]-4-quinolinecarboxamide IUPAC Name: N-(2-benzylsulfanylethyl)-2-methylquinoline-4-carboxamide Traditional Name: N-[2-(benzylthio)ethyl]-2-methyl-cinchoninamide Formula: C20H20N2OS MolecularWeight: 336.4506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)C(=O)NCCSCC3=CC=CC=C3

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)C(=O)NCCSCC3=CC=CC=C3

InChI

InChI=1S/C20H20N2OS/c1-15-13-18(17-9-5-6-10-19(17)22-15)20(23)21-11-12-24-14-16-7-3-2-4-8-16/h2-10,13H,11-12,14H2,1H3,(H,21,23)