(2S)-3-methyl-N-(4-pentylphenyl)-2-(phenylsulfonylamino)butanamide

Systemtic Name: (2S)-3-methyl-N-(4-pentylphenyl)-2-(phenylsulfonylamino)butanamide Openeye Name: (2S)-2-(benzenesulfonamido)-3-methyl-N-(4-pentylphenyl)butanamide CAS Name: (2S)-2-(benzenesulfonamido)-3-methyl-N-(4-pentylphenyl)butanamide IUPAC Name: (2S)-2-(benzenesulfonamido)-3-methyl-N-(4-pentylphenyl)butanamide Traditional Name: (2S)-N-(4-amylphenyl)-2-(benzenesulfonamido)-3-methyl-butyramide Formula: C22H30N2O3S MolecularWeight: 402.5502

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)NC(=O)C(C(C)C)NS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCCC1=CC=C(C=C1)NC(=O)[C@H](C(C)C)NS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C22H30N2O3S/c1-4-5-7-10-18-13-15-19(16-14-18)23-22(25)21(17(2)3)24-28(26,27)20-11-8-6-9-12-20/h6,8-9,11-17,21,24H,4-5,7,10H2,1-3H3,(H,23,25)/t21-/m0/s1