N-(5-chloranyl-2-pyrrolidin-1-yl-phenyl)-2-fluoranyl-5-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-(5-chloranyl-2-pyrrolidin-1-yl-phenyl)-2-fluoranyl-5-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-(5-chloro-2-pyrrolidin-1-yl-phenyl)-2-fluoro-5-morpholinosulfonyl-benzamide CAS Name: N-[5-chloro-2-(1-pyrrolidinyl)phenyl]-2-fluoro-5-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-(5-chloro-2-pyrrolidin-1-ylphenyl)-2-fluoro-5-morpholin-4-ylsulfonylbenzamide Traditional Name: N-(5-chloro-2-pyrrolidino-phenyl)-2-fluoro-5-morpholinosulfonyl-benzamide Formula: C21H23ClFN3O4S MolecularWeight: 467.941423

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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