N-(2-methyl-5-morpholin-4-ylsulfonyl-phenyl)-2-(4-methylquinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(2-methyl-5-morpholin-4-ylsulfonyl-phenyl)-2-(4-methylquinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(2-methyl-5-morpholinosulfonyl-phenyl)-2-[(4-methyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-[2-methyl-5-(4-morpholinylsulfonyl)phenyl]-2-[(4-methyl-2-quinolinyl)thio]acetamide IUPAC Name: N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)-2-(4-methylquinolin-2-yl)sulfanylacetamide Traditional Name: N-(2-methyl-5-morpholinosulfonyl-phenyl)-2-[(4-methyl-2-quinolyl)thio]acetamide Formula: C23H25N3O4S2 MolecularWeight: 471.5923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)CSC3=NC4=CC=CC=C4C(=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)CSC3=NC4=CC=CC=C4C(=C3)C

InChI

InChI=1S/C23H25N3O4S2/c1-16-7-8-18(32(28,29)26-9-11-30-12-10-26)14-21(16)24-22(27)15-31-23-13-17(2)19-5-3-4-6-20(19)25-23/h3-8,13-14H,9-12,15H2,1-2H3,(H,24,27)