N-(3,5-dimethylphenyl)-2-(6-methoxy-3-methyl-quinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(3,5-dimethylphenyl)-2-(6-methoxy-3-methyl-quinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(3,5-dimethylphenyl)-2-[(6-methoxy-3-methyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-(3,5-dimethylphenyl)-2-[(6-methoxy-3-methyl-2-quinolinyl)thio]acetamide IUPAC Name: N-(3,5-dimethylphenyl)-2-(6-methoxy-3-methylquinolin-2-yl)sulfanylacetamide Traditional Name: N-(3,5-dimethylphenyl)-2-[(6-methoxy-3-methyl-2-quinolyl)thio]acetamide Formula: C21H22N2O2S MolecularWeight: 366.47658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)CSC2=C(C=C3C=C(C=CC3=N2)OC)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)CSC2=C(C=C3C=C(C=CC3=N2)OC)C)C

InChI

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