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

Systemtic Name: 5-(azepan-1-ylsulfonyl)-N-[3,4-bis(fluoranyl)phenyl]-2-fluoranyl-benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-N-(3,4-difluorophenyl)-2-fluoro-benzamide CAS Name: 5-(1-azepanylsulfonyl)-N-(3,4-difluorophenyl)-2-fluorobenzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-N-(3,4-difluorophenyl)-2-fluorobenzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-N-(3,4-difluorophenyl)-2-fluoro-benzamide Formula: C19H19F3N2O3S MolecularWeight: 412.42597

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)F)C(=O)NC3=CC(=C(C=C3)F)F

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)F)C(=O)NC3=CC(=C(C=C3)F)F

InChI

InChI=1S/C19H19F3N2O3S/c20-16-8-6-14(28(26,27)24-9-3-1-2-4-10-24)12-15(16)19(25)23-13-5-7-17(21)18(22)11-13/h5-8,11-12H,1-4,9-10H2,(H,23,25)