2-[(3-fluorophenyl)-(4-methylsulfanylphenyl)sulfonyl-amino]-N-(3-morpholin-4-ylpropyl)ethanamide

Systemtic Name: 2-[(3-fluorophenyl)-(4-methylsulfanylphenyl)sulfonyl-amino]-N-(3-morpholin-4-ylpropyl)ethanamide Openeye Name: 2-(3-fluoro-N-(4-methylsulfanylphenyl)sulfonyl-anilino)-N-(3-morpholinopropyl)acetamide CAS Name: 2-(3-fluoro-N-[4-(methylthio)phenyl]sulfonylanilino)-N-[3-(4-morpholinyl)propyl]acetamide IUPAC Name: 2-(3-fluoro-N-(4-methylsulfanylphenyl)sulfonylanilino)-N-(3-morpholin-4-ylpropyl)acetamide Traditional Name: 2-(3-fluoro-N-[4-(methylthio)phenyl]sulfonyl-anilino)-N-(3-morpholinopropyl)acetamide Formula: C22H28FN3O4S2 MolecularWeight: 481.603823

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NCCCN2CCOCC2)C3=CC(=CC=C3)F

Isomeric SMILES

CSC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NCCCN2CCOCC2)C3=CC(=CC=C3)F

InChI

InChI=1S/C22H28FN3O4S2/c1-31-20-6-8-21(9-7-20)32(28,29)26(19-5-2-4-18(23)16-19)17-22(27)24-10-3-11-25-12-14-30-15-13-25/h2,4-9,16H,3,10-15,17H2,1H3,(H,24,27)