5-(azepan-1-ylsulfonyl)-N-(5-chloranyl-2-methoxy-phenyl)-2-fluoranyl-benzamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-N-(5-chloranyl-2-methoxy-phenyl)-2-fluoranyl-benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-N-(5-chloro-2-methoxy-phenyl)-2-fluoro-benzamide CAS Name: 5-(1-azepanylsulfonyl)-N-(5-chloro-2-methoxyphenyl)-2-fluorobenzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-N-(5-chloro-2-methoxyphenyl)-2-fluorobenzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-N-(5-chloro-2-methoxy-phenyl)-2-fluoro-benzamide Formula: C20H22ClFN2O4S MolecularWeight: 440.916083

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)F

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)F

InChI

InChI=1S/C20H22ClFN2O4S/c1-28-19-9-6-14(21)12-18(19)23-20(25)16-13-15(7-8-17(16)22)29(26,27)24-10-4-2-3-5-11-24/h6-9,12-13H,2-5,10-11H2,1H3,(H,23,25)