3-(azepan-1-ylsulfonyl)-N-(4-bromanyl-2-fluoranyl-phenyl)benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-(4-bromanyl-2-fluoranyl-phenyl)benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-(4-bromo-2-fluoro-phenyl)benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-(4-bromo-2-fluorophenyl)benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-(4-bromo-2-fluorophenyl)benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-(4-bromo-2-fluoro-phenyl)benzamide Formula: C19H20BrFN2O3S MolecularWeight: 455.341103

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20BrFN2O3S/c20-15-8-9-18(17(21)13-15)22-19(24)14-6-5-7-16(12-14)27(25,26)23-10-3-1-2-4-11-23/h5-9,12-13H,1-4,10-11H2,(H,22,24)