2-(3-cyano-6-ethyl-quinolin-2-yl)sulfanyl-N-phenethyl-ethanamide

Systemtic Name: 2-(3-cyano-6-ethyl-quinolin-2-yl)sulfanyl-N-phenethyl-ethanamide Openeye Name: 2-[(3-cyano-6-ethyl-2-quinolyl)sulfanyl]-N-phenethyl-acetamide CAS Name: 2-[(3-cyano-6-ethyl-2-quinolinyl)thio]-N-phenethylacetamide IUPAC Name: 2-(3-cyano-6-ethylquinolin-2-yl)sulfanyl-N-phenethylacetamide Traditional Name: 2-[(3-cyano-6-ethyl-2-quinolyl)thio]-N-phenethyl-acetamide Formula: C22H21N3OS MolecularWeight: 375.48664

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(C(=C2)C#N)SCC(=O)NCCC3=CC=CC=C3

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(C(=C2)C#N)SCC(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C22H21N3OS/c1-2-16-8-9-20-18(12-16)13-19(14-23)22(25-20)27-15-21(26)24-11-10-17-6-4-3-5-7-17/h3-9,12-13H,2,10-11,15H2,1H3,(H,24,26)