2-(7-methoxy-4-phenyl-quinolin-2-yl)sulfanyl-N-(4-methylsulfonylphenyl)ethanamide

Systemtic Name: 2-(7-methoxy-4-phenyl-quinolin-2-yl)sulfanyl-N-(4-methylsulfonylphenyl)ethanamide Openeye Name: 2-[(7-methoxy-4-phenyl-2-quinolyl)sulfanyl]-N-(4-methylsulfonylphenyl)acetamide CAS Name: 2-[(7-methoxy-4-phenyl-2-quinolinyl)thio]-N-(4-methylsulfonylphenyl)acetamide IUPAC Name: 2-(7-methoxy-4-phenylquinolin-2-yl)sulfanyl-N-(4-methylsulfonylphenyl)acetamide Traditional Name: N-(4-mesylphenyl)-2-[(7-methoxy-4-phenyl-2-quinolyl)thio]acetamide Formula: C25H22N2O4S2 MolecularWeight: 478.58318

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=N2)SCC(=O)NC3=CC=C(C=C3)S(=O)(=O)C)C4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=N2)SCC(=O)NC3=CC=C(C=C3)S(=O)(=O)C)C4=CC=CC=C4

InChI

InChI=1S/C25H22N2O4S2/c1-31-19-10-13-21-22(17-6-4-3-5-7-17)15-25(27-23(21)14-19)32-16-24(28)26-18-8-11-20(12-9-18)33(2,29)30/h3-15H,16H2,1-2H3,(H,26,28)