N-[2-(cyanomethylsulfanyl)phenyl]-2-(4-methylquinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[2-(cyanomethylsulfanyl)phenyl]-2-(4-methylquinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-[2-(cyanomethylsulfanyl)phenyl]-2-[(4-methyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-[2-(cyanomethylthio)phenyl]-2-[(4-methyl-2-quinolinyl)thio]acetamide IUPAC Name: N-[2-(cyanomethylsulfanyl)phenyl]-2-(4-methylquinolin-2-yl)sulfanylacetamide Traditional Name: N-[2-(cyanomethylthio)phenyl]-2-[(4-methyl-2-quinolyl)thio]acetamide Formula: C20H17N3OS2 MolecularWeight: 379.49848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)SCC(=O)NC3=CC=CC=C3SCC#N

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)SCC(=O)NC3=CC=CC=C3SCC#N

InChI

InChI=1S/C20H17N3OS2/c1-14-12-20(23-16-7-3-2-6-15(14)16)26-13-19(24)22-17-8-4-5-9-18(17)25-11-10-21/h2-9,12H,11,13H2,1H3,(H,22,24)