N-(2,5-dimethylphenyl)-4-[(4-fluorophenyl)-methylsulfonyl-amino]butanamide

Systemtic Name: N-(2,5-dimethylphenyl)-4-[(4-fluorophenyl)-methylsulfonyl-amino]butanamide Openeye Name: N-(2,5-dimethylphenyl)-4-(4-fluoro-N-methylsulfonyl-anilino)butanamide CAS Name: N-(2,5-dimethylphenyl)-4-(4-fluoro-N-methylsulfonylanilino)butanamide IUPAC Name: N-(2,5-dimethylphenyl)-4-(4-fluoro-N-methylsulfonylanilino)butanamide Traditional Name: N-(2,5-dimethylphenyl)-4-(4-fluoro-N-mesyl-anilino)butyramide Formula: C19H23FN2O3S MolecularWeight: 378.460923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)CCCN(C2=CC=C(C=C2)F)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)CCCN(C2=CC=C(C=C2)F)S(=O)(=O)C

InChI

InChI=1S/C19H23FN2O3S/c1-14-6-7-15(2)18(13-14)21-19(23)5-4-12-22(26(3,24)25)17-10-8-16(20)9-11-17/h6-11,13H,4-5,12H2,1-3H3,(H,21,23)