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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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