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

Systemtic Name: 5-(azepan-1-ylsulfonyl)-N-(2-ethoxyphenyl)-2-fluoranyl-benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-N-(2-ethoxyphenyl)-2-fluoro-benzamide CAS Name: 5-(1-azepanylsulfonyl)-N-(2-ethoxyphenyl)-2-fluorobenzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-N-(2-ethoxyphenyl)-2-fluorobenzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-2-fluoro-N-o-phenetyl-benzamide Formula: C21H25FN2O4S MolecularWeight: 420.497603

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)F

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)F

InChI

InChI=1S/C21H25FN2O4S/c1-2-28-20-10-6-5-9-19(20)23-21(25)17-15-16(11-12-18(17)22)29(26,27)24-13-7-3-4-8-14-24/h5-6,9-12,15H,2-4,7-8,13-14H2,1H3,(H,23,25)