N-(2-methyl-5-morpholin-4-ylsulfonyl-phenyl)-2-(4,6,8-trimethylquinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(2-methyl-5-morpholin-4-ylsulfonyl-phenyl)-2-(4,6,8-trimethylquinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(2-methyl-5-morpholinosulfonyl-phenyl)-2-[(4,6,8-trimethyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-[2-methyl-5-(4-morpholinylsulfonyl)phenyl]-2-[(4,6,8-trimethyl-2-quinolinyl)thio]acetamide IUPAC Name: N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)-2-(4,6,8-trimethylquinolin-2-yl)sulfanylacetamide Traditional Name: N-(2-methyl-5-morpholinosulfonyl-phenyl)-2-[(4,6,8-trimethyl-2-quinolyl)thio]acetamide Formula: C25H29N3O4S2 MolecularWeight: 499.64546

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H29N3O4S2/c1-16-11-19(4)25-21(12-16)18(3)13-24(27-25)33-15-23(29)26-22-14-20(6-5-17(22)2)34(30,31)28-7-9-32-10-8-28/h5-6,11-14H,7-10,15H2,1-4H3,(H,26,29)