5-(azepan-1-ylsulfonyl)-N-(2-bromophenyl)-2-fluoranyl-benzamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-N-(2-bromophenyl)-2-fluoranyl-benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-N-(2-bromophenyl)-2-fluoro-benzamide CAS Name: 5-(1-azepanylsulfonyl)-N-(2-bromophenyl)-2-fluorobenzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-N-(2-bromophenyl)-2-fluorobenzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-N-(2-bromophenyl)-2-fluoro-benzamide Formula: C19H20BrFN2O3S MolecularWeight: 455.341103

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)F)C(=O)NC3=CC=CC=C3Br

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)F)C(=O)NC3=CC=CC=C3Br

InChI

InChI=1S/C19H20BrFN2O3S/c20-16-7-3-4-8-18(16)22-19(24)15-13-14(9-10-17(15)21)27(25,26)23-11-5-1-2-6-12-23/h3-4,7-10,13H,1-2,5-6,11-12H2,(H,22,24)