(2S)-N-[4-(4-fluoranylphenoxy)butyl]-4-methylsulfanyl-2-(phenylsulfonylamino)butanamide

Systemtic Name: (2S)-N-[4-(4-fluoranylphenoxy)butyl]-4-methylsulfanyl-2-(phenylsulfonylamino)butanamide Openeye Name: (2S)-2-(benzenesulfonamido)-N-[4-(4-fluorophenoxy)butyl]-4-methylsulfanyl-butanamide CAS Name: (2S)-2-(benzenesulfonamido)-N-[4-(4-fluorophenoxy)butyl]-4-(methylthio)butanamide IUPAC Name: (2S)-2-(benzenesulfonamido)-N-[4-(4-fluorophenoxy)butyl]-4-methylsulfanylbutanamide Traditional Name: (2S)-2-(benzenesulfonamido)-N-[4-(4-fluorophenoxy)butyl]-4-(methylthio)butyramide Formula: C21H27FN2O4S2 MolecularWeight: 454.578483

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NCCCCOC1=CC=C(C=C1)F)NS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CSCC[C@@H](C(=O)NCCCCOC1=CC=C(C=C1)F)NS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H27FN2O4S2/c1-29-16-13-20(24-30(26,27)19-7-3-2-4-8-19)21(25)23-14-5-6-15-28-18-11-9-17(22)10-12-18/h2-4,7-12,20,24H,5-6,13-16H2,1H3,(H,23,25)/t20-/m0/s1