N-[5-(azepan-1-ylsulfonyl)-2-chloranyl-phenyl]-2-(3-chloranyl-4-fluoranyl-phenoxy)ethanamide

Systemtic Name: N-[5-(azepan-1-ylsulfonyl)-2-chloranyl-phenyl]-2-(3-chloranyl-4-fluoranyl-phenoxy)ethanamide Openeye Name: N-[5-(azepan-1-ylsulfonyl)-2-chloro-phenyl]-2-(3-chloro-4-fluoro-phenoxy)acetamide CAS Name: N-[5-(1-azepanylsulfonyl)-2-chlorophenyl]-2-(3-chloro-4-fluorophenoxy)acetamide IUPAC Name: N-[5-(azepan-1-ylsulfonyl)-2-chlorophenyl]-2-(3-chloro-4-fluorophenoxy)acetamide Traditional Name: N-[5-(azepan-1-ylsulfonyl)-2-chloro-phenyl]-2-(3-chloro-4-fluoro-phenoxy)acetamide Formula: C20H21Cl2FN2O4S MolecularWeight: 475.361143

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)NC(=O)COC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)NC(=O)COC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C20H21Cl2FN2O4S/c21-16-7-6-15(30(27,28)25-9-3-1-2-4-10-25)12-19(16)24-20(26)13-29-14-5-8-18(23)17(22)11-14/h5-8,11-12H,1-4,9-10,13H2,(H,24,26)