2-(3-cyano-7-ethoxy-quinolin-2-yl)sulfanyl-N-(phenylmethyl)ethanamide

Systemtic Name: 2-(3-cyano-7-ethoxy-quinolin-2-yl)sulfanyl-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[(3-cyano-7-ethoxy-2-quinolyl)sulfanyl]acetamide CAS Name: 2-[(3-cyano-7-ethoxy-2-quinolinyl)thio]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-(3-cyano-7-ethoxyquinolin-2-yl)sulfanylacetamide Traditional Name: N-benzyl-2-[(3-cyano-7-ethoxy-2-quinolyl)thio]acetamide Formula: C21H19N3O2S MolecularWeight: 377.45946

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)C=C(C(=N2)SCC(=O)NCC3=CC=CC=C3)C#N

Isomeric SMILES

CCOC1=CC2=C(C=C1)C=C(C(=N2)SCC(=O)NCC3=CC=CC=C3)C#N

InChI

InChI=1S/C21H19N3O2S/c1-2-26-18-9-8-16-10-17(12-22)21(24-19(16)11-18)27-14-20(25)23-13-15-6-4-3-5-7-15/h3-11H,2,13-14H2,1H3,(H,23,25)