N-(5-methyl-2-oxidanyl-phenyl)-2-(3,7,8-trimethylquinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(5-methyl-2-oxidanyl-phenyl)-2-(3,7,8-trimethylquinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(2-hydroxy-5-methyl-phenyl)-2-[(3,7,8-trimethyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-(2-hydroxy-5-methylphenyl)-2-[(3,7,8-trimethyl-2-quinolinyl)thio]acetamide IUPAC Name: N-(2-hydroxy-5-methylphenyl)-2-(3,7,8-trimethylquinolin-2-yl)sulfanylacetamide Traditional Name: N-(2-hydroxy-5-methyl-phenyl)-2-[(3,7,8-trimethyl-2-quinolyl)thio]acetamide Formula: C21H22N2O2S MolecularWeight: 366.47658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)O)NC(=O)CSC2=C(C=C3C=CC(=C(C3=N2)C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)O)NC(=O)CSC2=C(C=C3C=CC(=C(C3=N2)C)C)C

InChI

InChI=1S/C21H22N2O2S/c1-12-5-8-18(24)17(9-12)22-19(25)11-26-21-14(3)10-16-7-6-13(2)15(4)20(16)23-21/h5-10,24H,11H2,1-4H3,(H,22,25)