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

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-chloranyl-N-(2-fluoranyl-4-methyl-phenyl)benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(2-fluoro-4-methyl-phenyl)benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-chloro-N-(2-fluoro-4-methylphenyl)benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(2-fluoro-4-methylphenyl)benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(2-fluoro-4-methyl-phenyl)benzamide Formula: C20H22ClFN2O3S MolecularWeight: 424.916683

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22ClFN2O3S/c1-14-6-9-18(17(22)12-14)23-20(25)15-7-8-16(21)19(13-15)28(26,27)24-10-4-2-3-5-11-24/h6-9,12-13H,2-5,10-11H2,1H3,(H,23,25)