4-[(4-fluorophenyl)-methylsulfonyl-amino]-N-(2-phenoxyphenyl)butanamide

Systemtic Name: 4-[(4-fluorophenyl)-methylsulfonyl-amino]-N-(2-phenoxyphenyl)butanamide Openeye Name: 4-(4-fluoro-N-methylsulfonyl-anilino)-N-(2-phenoxyphenyl)butanamide CAS Name: 4-(4-fluoro-N-methylsulfonylanilino)-N-(2-phenoxyphenyl)butanamide IUPAC Name: 4-(4-fluoro-N-methylsulfonylanilino)-N-(2-phenoxyphenyl)butanamide Traditional Name: 4-(4-fluoro-N-mesyl-anilino)-N-(2-phenoxyphenyl)butyramide Formula: C23H23FN2O4S MolecularWeight: 442.503123

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CCCC(=O)NC1=CC=CC=C1OC2=CC=CC=C2)C3=CC=C(C=C3)F

Isomeric SMILES

CS(=O)(=O)N(CCCC(=O)NC1=CC=CC=C1OC2=CC=CC=C2)C3=CC=C(C=C3)F

InChI

InChI=1S/C23H23FN2O4S/c1-31(28,29)26(19-15-13-18(24)14-16-19)17-7-12-23(27)25-21-10-5-6-11-22(21)30-20-8-3-2-4-9-20/h2-6,8-11,13-16H,7,12,17H2,1H3,(H,25,27)