S-(phenylmethyl) (2S)-2-azanyl-4-methyl-pentanethioate

Systemtic Name: S-(phenylmethyl) (2S)-2-azanyl-4-methyl-pentanethioate Openeye Name: S-benzyl (2S)-2-amino-4-methyl-pentanethioate CAS Name: (2S)-2-amino-4-methylpentanethioic acid S-(phenylmethyl) ester IUPAC Name: S-benzyl (2S)-2-amino-4-methylpentanethioate Traditional Name: (2S)-2-amino-4-methyl-pentanethioic acid S-benzyl ester Formula: C13H19NOS MolecularWeight: 237.36106

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)SCC1=CC=CC=C1)N

Isomeric SMILES

CC(C)C[C@@H](C(=O)SCC1=CC=CC=C1)N

InChI

InChI=1S/C13H19NOS/c1-10(2)8-12(14)13(15)16-9-11-6-4-3-5-7-11/h3-7,10,12H,8-9,14H2,1-2H3/t12-/m0/s1