(2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]-N-(2-phenylbutyl)butanamide

Systemtic Name: (2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]-N-(2-phenylbutyl)butanamide Openeye Name: (2S)-3-methyl-N-(2-phenylbutyl)-2-(p-tolylsulfonylamino)butanamide CAS Name: (2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]-N-(2-phenylbutyl)butanamide IUPAC Name: (2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]-N-(2-phenylbutyl)butanamide Traditional Name: (2S)-3-methyl-N-(2-phenylbutyl)-2-(tosylamino)butyramide Formula: C22H30N2O3S MolecularWeight: 402.5502

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC(=O)C(C(C)C)NS(=O)(=O)C1=CC=C(C=C1)C)C2=CC=CC=C2

Isomeric SMILES

CCC(CNC(=O)[C@H](C(C)C)NS(=O)(=O)C1=CC=C(C=C1)C)C2=CC=CC=C2

InChI

InChI=1S/C22H30N2O3S/c1-5-18(19-9-7-6-8-10-19)15-23-22(25)21(16(2)3)24-28(26,27)20-13-11-17(4)12-14-20/h6-14,16,18,21,24H,5,15H2,1-4H3,(H,23,25)/t18?,21-/m0/s1