2-azanyl-3-oxidanylidene-4-(phenylmethyl)-5-sulfanyl-pentanoic acid

Systemtic Name: 2-azanyl-3-oxidanylidene-4-(phenylmethyl)-5-sulfanyl-pentanoic acid Openeye Name: 2-amino-4-benzyl-3-oxo-5-sulfanyl-pentanoic acid CAS Name: 2-amino-4-(mercaptomethyl)-3-oxo-5-phenylpentanoic acid IUPAC Name: 2-amino-4-benzyl-3-oxo-5-sulfanylpentanoic acid Traditional Name: 2-amino-4-benzyl-3-keto-5-mercapto-valeric acid Formula: C12H15NO3S MolecularWeight: 253.3174

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15NO3S/c13-10(12(15)16)11(14)9(7-17)6-8-4-2-1-3-5-8/h1-5,9-10,17H,6-7,13H2,(H,15,16)