N-[(3-ethoxyphenyl)methyl]-4-[(4-fluorophenyl)-methylsulfonyl-amino]butanamide

Systemtic Name: N-[(3-ethoxyphenyl)methyl]-4-[(4-fluorophenyl)-methylsulfonyl-amino]butanamide Openeye Name: N-[(3-ethoxyphenyl)methyl]-4-(4-fluoro-N-methylsulfonyl-anilino)butanamide CAS Name: N-[(3-ethoxyphenyl)methyl]-4-(4-fluoro-N-methylsulfonylanilino)butanamide IUPAC Name: N-[(3-ethoxyphenyl)methyl]-4-(4-fluoro-N-methylsulfonylanilino)butanamide Traditional Name: N-(3-ethoxybenzyl)-4-(4-fluoro-N-mesyl-anilino)butyramide Formula: C20H25FN2O4S MolecularWeight: 408.486903

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)CNC(=O)CCCN(C2=CC=C(C=C2)F)S(=O)(=O)C

Isomeric SMILES

CCOC1=CC=CC(=C1)CNC(=O)CCCN(C2=CC=C(C=C2)F)S(=O)(=O)C

InChI

InChI=1S/C20H25FN2O4S/c1-3-27-19-7-4-6-16(14-19)15-22-20(24)8-5-13-23(28(2,25)26)18-11-9-17(21)10-12-18/h4,6-7,9-12,14H,3,5,8,13,15H2,1-2H3,(H,22,24)