N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-fluoranyl-benzamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-fluoranyl-benzamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-fluoro-benzamide CAS Name: N-[3-(1-azepanylsulfonyl)-4-methylphenyl]-2-fluorobenzamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]-2-fluorobenzamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-fluoro-benzamide Formula: C20H23FN2O3S MolecularWeight: 390.471623

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC=CC=C2F)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC=CC=C2F)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C20H23FN2O3S/c1-15-10-11-16(22-20(24)17-8-4-5-9-18(17)21)14-19(15)27(25,26)23-12-6-2-3-7-13-23/h4-5,8-11,14H,2-3,6-7,12-13H2,1H3,(H,22,24)