N-(4-chloranyl-3-morpholin-4-ylsulfonyl-phenyl)-2-(4-methylquinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(4-chloranyl-3-morpholin-4-ylsulfonyl-phenyl)-2-(4-methylquinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(4-chloro-3-morpholinosulfonyl-phenyl)-2-[(4-methyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-[4-chloro-3-(4-morpholinylsulfonyl)phenyl]-2-[(4-methyl-2-quinolinyl)thio]acetamide IUPAC Name: N-(4-chloro-3-morpholin-4-ylsulfonylphenyl)-2-(4-methylquinolin-2-yl)sulfanylacetamide Traditional Name: N-(4-chloro-3-morpholinosulfonyl-phenyl)-2-[(4-methyl-2-quinolyl)thio]acetamide Formula: C22H22ClN3O4S2 MolecularWeight: 492.01078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)SCC(=O)NC3=CC(=C(C=C3)Cl)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)SCC(=O)NC3=CC(=C(C=C3)Cl)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C22H22ClN3O4S2/c1-15-12-22(25-19-5-3-2-4-17(15)19)31-14-21(27)24-16-6-7-18(23)20(13-16)32(28,29)26-8-10-30-11-9-26/h2-7,12-13H,8-11,14H2,1H3,(H,24,27)