3-[(2-azanyl-3-sulfanyl-propanoyl)amino]-2-oxidanyl-4-phenyl-butanoic acid

Systemtic Name: 3-[(2-azanyl-3-sulfanyl-propanoyl)amino]-2-oxidanyl-4-phenyl-butanoic acid Openeye Name: 3-[(2-amino-3-sulfanyl-propanoyl)amino]-2-hydroxy-4-phenyl-butanoic acid CAS Name: 3-[(2-amino-3-mercapto-1-oxopropyl)amino]-2-hydroxy-4-phenylbutanoic acid IUPAC Name: 3-[(2-amino-3-sulfanylpropanoyl)amino]-2-hydroxy-4-phenylbutanoic acid Traditional Name: 3-[(2-amino-3-mercapto-propanoyl)amino]-2-hydroxy-4-phenyl-butyric acid Formula: C13H18N2O4S MolecularWeight: 298.35802

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18N2O4S/c14-9(7-20)12(17)15-10(11(16)13(18)19)6-8-4-2-1-3-5-8/h1-5,9-11,16,20H,6-7,14H2,(H,15,17)(H,18,19)