5-chloranyl-N-[2-(diethylamino)-5-morpholin-4-ylsulfonyl-phenyl]-2-fluoranyl-benzamide

Systemtic Name: 5-chloranyl-N-[2-(diethylamino)-5-morpholin-4-ylsulfonyl-phenyl]-2-fluoranyl-benzamide Openeye Name: 5-chloro-N-[2-(diethylamino)-5-morpholinosulfonyl-phenyl]-2-fluoro-benzamide CAS Name: 5-chloro-N-[2-(diethylamino)-5-(4-morpholinylsulfonyl)phenyl]-2-fluorobenzamide IUPAC Name: 5-chloro-N-[2-(diethylamino)-5-morpholin-4-ylsulfonylphenyl]-2-fluorobenzamide Traditional Name: 5-chloro-N-[2-(diethylamino)-5-morpholinosulfonyl-phenyl]-2-fluoro-benzamide Formula: C21H25ClFN3O4S MolecularWeight: 469.957303

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)C3=C(C=CC(=C3)Cl)F

Isomeric SMILES

CCN(CC)C1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)C3=C(C=CC(=C3)Cl)F

InChI

InChI=1S/C21H25ClFN3O4S/c1-3-25(4-2)20-8-6-16(31(28,29)26-9-11-30-12-10-26)14-19(20)24-21(27)17-13-15(22)5-7-18(17)23/h5-8,13-14H,3-4,9-12H2,1-2H3,(H,24,27)