(2S)-2-acetamido-3-methyl-N-[2-[(4-methylphenyl)methylsulfanyl]ethyl]butanamide

Systemtic Name: (2S)-2-acetamido-3-methyl-N-[2-[(4-methylphenyl)methylsulfanyl]ethyl]butanamide Openeye Name: (2S)-2-acetamido-3-methyl-N-[2-(p-tolylmethylsulfanyl)ethyl]butanamide CAS Name: (2S)-2-acetamido-3-methyl-N-[2-[(4-methylphenyl)methylthio]ethyl]butanamide IUPAC Name: (2S)-2-acetamido-3-methyl-N-[2-[(4-methylphenyl)methylsulfanyl]ethyl]butanamide Traditional Name: (2S)-2-acetamido-3-methyl-N-[2-[(4-methylbenzyl)thio]ethyl]butyramide Formula: C17H26N2O2S MolecularWeight: 322.46554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSCCNC(=O)C(C(C)C)NC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)CSCCNC(=O)[C@H](C(C)C)NC(=O)C

InChI

InChI=1S/C17H26N2O2S/c1-12(2)16(19-14(4)20)17(21)18-9-10-22-11-15-7-5-13(3)6-8-15/h5-8,12,16H,9-11H2,1-4H3,(H,18,21)(H,19,20)/t16-/m0/s1