(2S,3S)-3-methyl-N-[(1S)-1-(4-methylsulfonylphenyl)ethyl]-2-phenyl-pentanamide

Systemtic Name: (2S,3S)-3-methyl-N-[(1S)-1-(4-methylsulfonylphenyl)ethyl]-2-phenyl-pentanamide Openeye Name: (2S,3S)-3-methyl-N-[(1S)-1-(4-methylsulfonylphenyl)ethyl]-2-phenyl-pentanamide CAS Name: (2S,3S)-3-methyl-N-[(1S)-1-(4-methylsulfonylphenyl)ethyl]-2-phenylpentanamide IUPAC Name: (2S,3S)-3-methyl-N-[(1S)-1-(4-methylsulfonylphenyl)ethyl]-2-phenylpentanamide Traditional Name: (2S,3S)-N-[(1S)-1-(4-mesylphenyl)ethyl]-3-methyl-2-phenyl-valeramide Formula: C21H27NO3S MolecularWeight: 373.50898

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27NO3S/c1-5-15(2)20(18-9-7-6-8-10-18)21(23)22-16(3)17-11-13-19(14-12-17)26(4,24)25/h6-16,20H,5H2,1-4H3,(H,22,23)/t15-,16-,20-/m0/s1