(2S)-2-[1-(4-methylphenyl)sulfonylethyl]-N-[(1R)-1-phenylethyl]pentanamide

Systemtic Name: (2S)-2-[1-(4-methylphenyl)sulfonylethyl]-N-[(1R)-1-phenylethyl]pentanamide Openeye Name: (2S)-N-[(1R)-1-phenylethyl]-2-[1-(p-tolylsulfonyl)ethyl]pentanamide CAS Name: (2S)-2-[1-(4-methylphenyl)sulfonylethyl]-N-[(1R)-1-phenylethyl]pentanamide IUPAC Name: (2S)-2-[1-(4-methylphenyl)sulfonylethyl]-N-[(1R)-1-phenylethyl]pentanamide Traditional Name: (2S)-N-[(1R)-1-phenylethyl]-2-(1-tosylethyl)valeramide Formula: C22H29NO3S MolecularWeight: 387.53556

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(C)S(=O)(=O)C1=CC=C(C=C1)C)C(=O)NC(C)C2=CC=CC=C2

Isomeric SMILES

CCC[C@H](C(C)S(=O)(=O)C1=CC=C(C=C1)C)C(=O)N[C@H](C)C2=CC=CC=C2

InChI

InChI=1S/C22H29NO3S/c1-5-9-21(22(24)23-17(3)19-10-7-6-8-11-19)18(4)27(25,26)20-14-12-16(2)13-15-20/h6-8,10-15,17-18,21H,5,9H2,1-4H3,(H,23,24)/t17-,18?,21-/m1/s1