2-azanyl-3-oxidanylidene-5-phenyl-2-(sulfanylmethyl)pentanoic acid

Systemtic Name: 2-azanyl-3-oxidanylidene-5-phenyl-2-(sulfanylmethyl)pentanoic acid Openeye Name: 2-amino-3-oxo-5-phenyl-2-(sulfanylmethyl)pentanoic acid CAS Name: 2-amino-2-(mercaptomethyl)-3-oxo-5-phenylpentanoic acid IUPAC Name: 2-amino-3-oxo-5-phenyl-2-(sulfanylmethyl)pentanoic acid Traditional Name: 2-amino-3-keto-2-(mercaptomethyl)-5-phenyl-valeric acid Formula: C12H15NO3S MolecularWeight: 253.3174

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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