N-(3-ethanoylphenyl)-2-(3,5,8-trimethylquinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(3-ethanoylphenyl)-2-(3,5,8-trimethylquinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(3-acetylphenyl)-2-[(3,5,8-trimethyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-(3-acetylphenyl)-2-[(3,5,8-trimethyl-2-quinolinyl)thio]acetamide IUPAC Name: N-(3-acetylphenyl)-2-(3,5,8-trimethylquinolin-2-yl)sulfanylacetamide Traditional Name: N-(3-acetylphenyl)-2-[(3,5,8-trimethyl-2-quinolyl)thio]acetamide Formula: C22H22N2O2S MolecularWeight: 378.48728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(C(=NC2=C(C=C1)C)SCC(=O)NC3=CC=CC(=C3)C(=O)C)C

Isomeric SMILES

CC1=C2C=C(C(=NC2=C(C=C1)C)SCC(=O)NC3=CC=CC(=C3)C(=O)C)C

InChI

InChI=1S/C22H22N2O2S/c1-13-8-9-14(2)21-19(13)10-15(3)22(24-21)27-12-20(26)23-18-7-5-6-17(11-18)16(4)25/h5-11H,12H2,1-4H3,(H,23,26)