N-(4-acetamidophenyl)-2-(3,6,8-trimethylquinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(4-acetamidophenyl)-2-(3,6,8-trimethylquinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(4-acetamidophenyl)-2-[(3,6,8-trimethyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-(4-acetamidophenyl)-2-[(3,6,8-trimethyl-2-quinolinyl)thio]acetamide IUPAC Name: N-(4-acetamidophenyl)-2-(3,6,8-trimethylquinolin-2-yl)sulfanylacetamide Traditional Name: N-(4-acetamidophenyl)-2-[(3,6,8-trimethyl-2-quinolyl)thio]acetamide Formula: C22H23N3O2S MolecularWeight: 393.50192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C=C(C(=N2)SCC(=O)NC3=CC=C(C=C3)NC(=O)C)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C=C(C(=N2)SCC(=O)NC3=CC=C(C=C3)NC(=O)C)C)C

InChI

InChI=1S/C22H23N3O2S/c1-13-9-14(2)21-17(10-13)11-15(3)22(25-21)28-12-20(27)24-19-7-5-18(6-8-19)23-16(4)26/h5-11H,12H2,1-4H3,(H,23,26)(H,24,27)