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

Systemtic Name: 5-(azepan-1-ylsulfonyl)-N-(4-bromanyl-2-fluoranyl-phenyl)-2-chloranyl-benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-N-(4-bromo-2-fluoro-phenyl)-2-chloro-benzamide CAS Name: 5-(1-azepanylsulfonyl)-N-(4-bromo-2-fluorophenyl)-2-chlorobenzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-N-(4-bromo-2-fluorophenyl)-2-chlorobenzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-N-(4-bromo-2-fluoro-phenyl)-2-chloro-benzamide Formula: C19H19BrClFN2O3S MolecularWeight: 489.786163

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19BrClFN2O3S/c20-13-5-8-18(17(22)11-13)23-19(25)15-12-14(6-7-16(15)21)28(26,27)24-9-3-1-2-4-10-24/h5-8,11-12H,1-4,9-10H2,(H,23,25)