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

Systemtic Name: 2-fluoranyl-N-(2-methyl-4-pyrrolidin-1-yl-phenyl)-5-morpholin-4-ylsulfonyl-benzamide Openeye Name: 2-fluoro-N-(2-methyl-4-pyrrolidin-1-yl-phenyl)-5-morpholinosulfonyl-benzamide CAS Name: 2-fluoro-N-[2-methyl-4-(1-pyrrolidinyl)phenyl]-5-(4-morpholinylsulfonyl)benzamide IUPAC Name: 2-fluoro-N-(2-methyl-4-pyrrolidin-1-ylphenyl)-5-morpholin-4-ylsulfonylbenzamide Traditional Name: 2-fluoro-N-(2-methyl-4-pyrrolidino-phenyl)-5-morpholinosulfonyl-benzamide Formula: C22H26FN3O4S MolecularWeight: 447.522943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CCCC2)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)F

Isomeric SMILES

CC1=C(C=CC(=C1)N2CCCC2)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)F

InChI

InChI=1S/C22H26FN3O4S/c1-16-14-17(25-8-2-3-9-25)4-7-21(16)24-22(27)19-15-18(5-6-20(19)23)31(28,29)26-10-12-30-13-11-26/h4-7,14-15H,2-3,8-13H2,1H3,(H,24,27)