4-[(2,5-dimethylphenyl)-methylsulfonyl-amino]-N-(3-ethanoylphenyl)butanamide

Systemtic Name: 4-[(2,5-dimethylphenyl)-methylsulfonyl-amino]-N-(3-ethanoylphenyl)butanamide Openeye Name: N-(3-acetylphenyl)-4-(2,5-dimethyl-N-methylsulfonyl-anilino)butanamide CAS Name: N-(3-acetylphenyl)-4-(2,5-dimethyl-N-methylsulfonylanilino)butanamide IUPAC Name: N-(3-acetylphenyl)-4-(2,5-dimethyl-N-methylsulfonylanilino)butanamide Traditional Name: N-(3-acetylphenyl)-4-(N-mesyl-2,5-dimethyl-anilino)butyramide Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N(CCCC(=O)NC2=CC=CC(=C2)C(=O)C)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)N(CCCC(=O)NC2=CC=CC(=C2)C(=O)C)S(=O)(=O)C

InChI

InChI=1S/C21H26N2O4S/c1-15-10-11-16(2)20(13-15)23(28(4,26)27)12-6-9-21(25)22-19-8-5-7-18(14-19)17(3)24/h5,7-8,10-11,13-14H,6,9,12H2,1-4H3,(H,22,25)