N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonyl-phenyl]-3,5-bis(fluoranyl)benzamide

Systemtic Name: N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonyl-phenyl]-3,5-bis(fluoranyl)benzamide Openeye Name: N-[2-(azepan-1-yl)-5-morpholinosulfonyl-phenyl]-3,5-difluoro-benzamide CAS Name: N-[2-(1-azepanyl)-5-(4-morpholinylsulfonyl)phenyl]-3,5-difluorobenzamide IUPAC Name: N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonylphenyl]-3,5-difluorobenzamide Traditional Name: N-[2-(azepan-1-yl)-5-morpholinosulfonyl-phenyl]-3,5-difluoro-benzamide Formula: C23H27F2N3O4S MolecularWeight: 479.539986

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)C4=CC(=CC(=C4)F)F

Isomeric SMILES

C1CCCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)C4=CC(=CC(=C4)F)F

InChI

InChI=1S/C23H27F2N3O4S/c24-18-13-17(14-19(25)15-18)23(29)26-21-16-20(33(30,31)28-9-11-32-12-10-28)5-6-22(21)27-7-3-1-2-4-8-27/h5-6,13-16H,1-4,7-12H2,(H,26,29)