2-[4-(azepan-1-ylsulfonyl)phenoxy]-N-(5-fluoranyl-2-methyl-phenyl)ethanamide

Systemtic Name: 2-[4-(azepan-1-ylsulfonyl)phenoxy]-N-(5-fluoranyl-2-methyl-phenyl)ethanamide Openeye Name: 2-[4-(azepan-1-ylsulfonyl)phenoxy]-N-(5-fluoro-2-methyl-phenyl)acetamide CAS Name: 2-[4-(1-azepanylsulfonyl)phenoxy]-N-(5-fluoro-2-methylphenyl)acetamide IUPAC Name: 2-[4-(azepan-1-ylsulfonyl)phenoxy]-N-(5-fluoro-2-methylphenyl)acetamide Traditional Name: 2-[4-(azepan-1-ylsulfonyl)phenoxy]-N-(5-fluoro-2-methyl-phenyl)acetamide Formula: C21H25FN2O4S MolecularWeight: 420.497603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)F)NC(=O)COC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)F)NC(=O)COC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C21H25FN2O4S/c1-16-6-7-17(22)14-20(16)23-21(25)15-28-18-8-10-19(11-9-18)29(26,27)24-12-4-2-3-5-13-24/h6-11,14H,2-5,12-13,15H2,1H3,(H,23,25)