4-[(4-chlorophenyl)-methylsulfonyl-amino]-N-(3-ethanoylphenyl)butanamide

Systemtic Name: 4-[(4-chlorophenyl)-methylsulfonyl-amino]-N-(3-ethanoylphenyl)butanamide Openeye Name: N-(3-acetylphenyl)-4-(4-chloro-N-methylsulfonyl-anilino)butanamide CAS Name: N-(3-acetylphenyl)-4-(4-chloro-N-methylsulfonylanilino)butanamide IUPAC Name: N-(3-acetylphenyl)-4-(4-chloro-N-methylsulfonylanilino)butanamide Traditional Name: N-(3-acetylphenyl)-4-(4-chloro-N-mesyl-anilino)butyramide Formula: C19H21ClN2O4S MolecularWeight: 408.89904

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)CCCN(C2=CC=C(C=C2)Cl)S(=O)(=O)C

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)CCCN(C2=CC=C(C=C2)Cl)S(=O)(=O)C

InChI

InChI=1S/C19H21ClN2O4S/c1-14(23)15-5-3-6-17(13-15)21-19(24)7-4-12-22(27(2,25)26)18-10-8-16(20)9-11-18/h3,5-6,8-11,13H,4,7,12H2,1-2H3,(H,21,24)