N-[(3,4-dimethoxyphenyl)methyl]-2-[(4-fluorophenyl)-methylsulfonyl-amino]butanamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[(4-fluorophenyl)-methylsulfonyl-amino]butanamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(4-fluoro-N-methylsulfonyl-anilino)butanamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(4-fluoro-N-methylsulfonylanilino)butanamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(4-fluoro-N-methylsulfonylanilino)butanamide Traditional Name: 2-(4-fluoro-N-mesyl-anilino)-N-veratryl-butyramide Formula: C20H25FN2O5S MolecularWeight: 424.486303

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCC1=CC(=C(C=C1)OC)OC)N(C2=CC=C(C=C2)F)S(=O)(=O)C

Isomeric SMILES

CCC(C(=O)NCC1=CC(=C(C=C1)OC)OC)N(C2=CC=C(C=C2)F)S(=O)(=O)C

InChI

InChI=1S/C20H25FN2O5S/c1-5-17(23(29(4,25)26)16-9-7-15(21)8-10-16)20(24)22-13-14-6-11-18(27-2)19(12-14)28-3/h6-12,17H,5,13H2,1-4H3,(H,22,24)