N-(2-chloranyl-5-methylsulfonyl-phenyl)-2-(7-methoxy-4-phenyl-quinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(2-chloranyl-5-methylsulfonyl-phenyl)-2-(7-methoxy-4-phenyl-quinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(2-chloro-5-methylsulfonyl-phenyl)-2-[(7-methoxy-4-phenyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-(2-chloro-5-methylsulfonylphenyl)-2-[(7-methoxy-4-phenyl-2-quinolinyl)thio]acetamide IUPAC Name: N-(2-chloro-5-methylsulfonylphenyl)-2-(7-methoxy-4-phenylquinolin-2-yl)sulfanylacetamide Traditional Name: N-(2-chloro-5-mesyl-phenyl)-2-[(7-methoxy-4-phenyl-2-quinolyl)thio]acetamide Formula: C25H21ClN2O4S2 MolecularWeight: 513.02824

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H21ClN2O4S2/c1-32-17-8-10-19-20(16-6-4-3-5-7-16)14-25(28-22(19)12-17)33-15-24(29)27-23-13-18(34(2,30)31)9-11-21(23)26/h3-14H,15H2,1-2H3,(H,27,29)