(2S)-2-[[(2R)-2-azanyl-3-sulfanyl-propanoyl]amino]-3-phenyl-propanoic acid

Systemtic Name: (2S)-2-[[(2R)-2-azanyl-3-sulfanyl-propanoyl]amino]-3-phenyl-propanoic acid Openeye Name: (2S)-2-[[(2R)-2-amino-3-sulfanyl-propanoyl]amino]-3-phenyl-propanoic acid CAS Name: (2S)-2-[[(2R)-2-amino-3-mercapto-1-oxopropyl]amino]-3-phenylpropanoic acid IUPAC Name: (2S)-2-[[(2R)-2-amino-3-sulfanylpropanoyl]amino]-3-phenylpropanoic acid Traditional Name: (2S)-2-[[(2R)-2-amino-3-mercapto-propanoyl]amino]-3-phenyl-propionic acid Formula: C12H16N2O3S MolecularWeight: 268.33204

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)NC(=O)C(CS)N

Isomeric SMILES

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

InChI

InChI=1S/C12H16N2O3S/c13-9(7-18)11(15)14-10(12(16)17)6-8-4-2-1-3-5-8/h1-5,9-10,18H,6-7,13H2,(H,14,15)(H,16,17)/t9-,10-/m0/s1