N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-[4-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-[4-(trifluoromethyl)phenyl]ethanamide Openeye Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-[4-(trifluoromethyl)phenyl]acetamide CAS Name: N-[5-(1-azepanylsulfonyl)-2-methoxyphenyl]-2-[4-(trifluoromethyl)phenyl]acetamide IUPAC Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxyphenyl]-2-[4-(trifluoromethyl)phenyl]acetamide Traditional Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-[4-(trifluoromethyl)phenyl]acetamide Formula: C22H25F3N2O4S MolecularWeight: 470.50511

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NC(=O)CC3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NC(=O)CC3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C22H25F3N2O4S/c1-31-20-11-10-18(32(29,30)27-12-4-2-3-5-13-27)15-19(20)26-21(28)14-16-6-8-17(9-7-16)22(23,24)25/h6-11,15H,2-5,12-14H2,1H3,(H,26,28)