N-(3-chloranyl-2-morpholin-4-yl-phenyl)-4-fluoranyl-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(3-chloranyl-2-morpholin-4-yl-phenyl)-4-fluoranyl-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(3-chloro-2-morpholino-phenyl)-4-fluoro-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[3-chloro-2-(4-morpholinyl)phenyl]-4-fluoro-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(3-chloro-2-morpholin-4-ylphenyl)-4-fluoro-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(3-chloro-2-morpholino-phenyl)-4-fluoro-3-pyrrolidinosulfonyl-benzamide Formula: C21H23ClFN3O4S MolecularWeight: 467.941423

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=C(C(=CC=C3)Cl)N4CCOCC4)F

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=C(C(=CC=C3)Cl)N4CCOCC4)F

InChI

InChI=1S/C21H23ClFN3O4S/c22-16-4-3-5-18(20(16)25-10-12-30-13-11-25)24-21(27)15-6-7-17(23)19(14-15)31(28,29)26-8-1-2-9-26/h3-7,14H,1-2,8-13H2,(H,24,27)