(2S)-N-(3,5-dimethylphenyl)-2-[(4-methoxyphenyl)sulfonylamino]-4-methyl-pentanamide

Systemtic Name: (2S)-N-(3,5-dimethylphenyl)-2-[(4-methoxyphenyl)sulfonylamino]-4-methyl-pentanamide Openeye Name: (2S)-N-(3,5-dimethylphenyl)-2-[(4-methoxyphenyl)sulfonylamino]-4-methyl-pentanamide CAS Name: (2S)-N-(3,5-dimethylphenyl)-2-[(4-methoxyphenyl)sulfonylamino]-4-methylpentanamide IUPAC Name: (2S)-N-(3,5-dimethylphenyl)-2-[(4-methoxyphenyl)sulfonylamino]-4-methylpentanamide Traditional Name: (2S)-N-(3,5-dimethylphenyl)-2-[(4-methoxyphenyl)sulfonylamino]-4-methyl-valeramide Formula: C21H28N2O4S MolecularWeight: 404.52302

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC(=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)10-20(21(24)22-17-12-15(3)11-16(4)13-17)23-28(25,26)19-8-6-18(27-5)7-9-19/h6-9,11-14,20,23H,10H2,1-5H3,(H,22,24)/t20-/m0/s1