3-(azepan-1-ylcarbonyl)-N-(4-fluorophenyl)-4-methyl-benzenesulfonamide

Systemtic Name: 3-(azepan-1-ylcarbonyl)-N-(4-fluorophenyl)-4-methyl-benzenesulfonamide Openeye Name: 3-(azepane-1-carbonyl)-N-(4-fluorophenyl)-4-methyl-benzenesulfonamide CAS Name: 3-[1-azepanyl(oxo)methyl]-N-(4-fluorophenyl)-4-methylbenzenesulfonamide IUPAC Name: 3-(azepane-1-carbonyl)-N-(4-fluorophenyl)-4-methylbenzenesulfonamide Traditional Name: 3-(azepane-1-carbonyl)-N-(4-fluorophenyl)-4-methyl-benzenesulfonamide Formula: C20H23FN2O3S MolecularWeight: 390.471623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)F)C(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)F)C(=O)N3CCCCCC3

InChI

InChI=1S/C20H23FN2O3S/c1-15-6-11-18(27(25,26)22-17-9-7-16(21)8-10-17)14-19(15)20(24)23-12-4-2-3-5-13-23/h6-11,14,22H,2-5,12-13H2,1H3