(2S)-2-acetamido-3-[(4-methylphenyl)diazenyl]sulfanyl-propanoate

Systemtic Name: (2S)-2-acetamido-3-[(4-methylphenyl)diazenyl]sulfanyl-propanoate Openeye Name: (2S)-2-acetamido-3-(p-tolylazosulfanyl)propanoate CAS Name: (2S)-2-acetamido-3-[(4-methylphenyl)azothio]propanoate IUPAC Name: (2S)-2-acetamido-3-[(4-methylphenyl)diazenyl]sulfanylpropanoate Traditional Name: (2S)-2-acetamido-3-(p-tolylazothio)propionate Formula: C12H14N3O3S- MolecularWeight: 280.32286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N=NSCC(C(=O)[O-])NC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)N=NSC[C@H](C(=O)[O-])NC(=O)C

InChI

InChI=1S/C12H15N3O3S/c1-8-3-5-10(6-4-8)14-15-19-7-11(12(17)18)13-9(2)16/h3-6,11H,7H2,1-2H3,(H,13,16)(H,17,18)/p-1/t11-/m1/s1