(2S)-2-[1-(4-methylphenyl)sulfonylethyl]-N-(phenylmethyl)hexanamide

Systemtic Name: (2S)-2-[1-(4-methylphenyl)sulfonylethyl]-N-(phenylmethyl)hexanamide Openeye Name: (2S)-N-benzyl-2-[1-(p-tolylsulfonyl)ethyl]hexanamide CAS Name: (2S)-2-[1-(4-methylphenyl)sulfonylethyl]-N-(phenylmethyl)hexanamide IUPAC Name: (2S)-N-benzyl-2-[1-(4-methylphenyl)sulfonylethyl]hexanamide Traditional Name: (2S)-N-benzyl-2-(1-tosylethyl)hexanamide Formula: C22H29NO3S MolecularWeight: 387.53556

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(C)S(=O)(=O)C1=CC=C(C=C1)C)C(=O)NCC2=CC=CC=C2

Isomeric SMILES

CCCC[C@H](C(C)S(=O)(=O)C1=CC=C(C=C1)C)C(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C22H29NO3S/c1-4-5-11-21(22(24)23-16-19-9-7-6-8-10-19)18(3)27(25,26)20-14-12-17(2)13-15-20/h6-10,12-15,18,21H,4-5,11,16H2,1-3H3,(H,23,24)/t18?,21-/m1/s1