(2S)-N-(2,3-dimethylphenyl)-2-[(4-methoxyphenyl)sulfonylamino]-4-methyl-pentanamide

Systemtic Name: (2S)-N-(2,3-dimethylphenyl)-2-[(4-methoxyphenyl)sulfonylamino]-4-methyl-pentanamide Openeye Name: (2S)-N-(2,3-dimethylphenyl)-2-[(4-methoxyphenyl)sulfonylamino]-4-methyl-pentanamide CAS Name: (2S)-N-(2,3-dimethylphenyl)-2-[(4-methoxyphenyl)sulfonylamino]-4-methylpentanamide IUPAC Name: (2S)-N-(2,3-dimethylphenyl)-2-[(4-methoxyphenyl)sulfonylamino]-4-methylpentanamide Traditional Name: (2S)-N-(2,3-dimethylphenyl)-2-[(4-methoxyphenyl)sulfonylamino]-4-methyl-valeramide Formula: C21H28N2O4S MolecularWeight: 404.52302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)C(CC(C)C)NS(=O)(=O)C2=CC=C(C=C2)OC)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)[C@H](CC(C)C)NS(=O)(=O)C2=CC=C(C=C2)OC)C

InChI

InChI=1S/C21H28N2O4S/c1-14(2)13-20(21(24)22-19-8-6-7-15(3)16(19)4)23-28(25,26)18-11-9-17(27-5)10-12-18/h6-12,14,20,23H,13H2,1-5H3,(H,22,24)/t20-/m0/s1