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

Systemtic Name: 2-(3-cyano-6-ethyl-quinolin-2-yl)sulfanyl-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[(3-cyano-6-ethyl-2-quinolyl)sulfanyl]acetamide CAS Name: 2-[(3-cyano-6-ethyl-2-quinolinyl)thio]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-(3-cyano-6-ethylquinolin-2-yl)sulfanylacetamide Traditional Name: N-benzyl-2-[(3-cyano-6-ethyl-2-quinolyl)thio]acetamide Formula: C21H19N3OS MolecularWeight: 361.46006

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(C(=C2)C#N)SCC(=O)NCC3=CC=CC=C3

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(C(=C2)C#N)SCC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C21H19N3OS/c1-2-15-8-9-19-17(10-15)11-18(12-22)21(24-19)26-14-20(25)23-13-16-6-4-3-5-7-16/h3-11H,2,13-14H2,1H3,(H,23,25)