N-(4-ethanoylphenyl)-2-(3,6,7-trimethylquinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(4-ethanoylphenyl)-2-(3,6,7-trimethylquinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(4-acetylphenyl)-2-[(3,6,7-trimethyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-(4-acetylphenyl)-2-[(3,6,7-trimethyl-2-quinolinyl)thio]acetamide IUPAC Name: N-(4-acetylphenyl)-2-(3,6,7-trimethylquinolin-2-yl)sulfanylacetamide Traditional Name: N-(4-acetylphenyl)-2-[(3,6,7-trimethyl-2-quinolyl)thio]acetamide Formula: C22H22N2O2S MolecularWeight: 378.48728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC(=C(C=C2N=C1SCC(=O)NC3=CC=C(C=C3)C(=O)C)C)C

Isomeric SMILES

CC1=CC2=CC(=C(C=C2N=C1SCC(=O)NC3=CC=C(C=C3)C(=O)C)C)C

InChI

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