N-(2,5-dimethylphenyl)-4-(phenylsulfonyl)butanamide

Systemtic Name: N-(2,5-dimethylphenyl)-4-(phenylsulfonyl)butanamide Openeye Name: 4-(benzenesulfonyl)-N-(2,5-dimethylphenyl)butanamide CAS Name: 4-(benzenesulfonyl)-N-(2,5-dimethylphenyl)butanamide IUPAC Name: 4-(benzenesulfonyl)-N-(2,5-dimethylphenyl)butanamide Traditional Name: 4-besyl-N-(2,5-dimethylphenyl)butyramide Formula: C18H21NO3S MolecularWeight: 331.42924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)CCCS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)CCCS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H21NO3S/c1-14-10-11-15(2)17(13-14)19-18(20)9-6-12-23(21,22)16-7-4-3-5-8-16/h3-5,7-8,10-11,13H,6,9,12H2,1-2H3,(H,19,20)