4-azanyl-4-oxidanylidene-2-[3-(phenylcarbonylsulfanyl)propanoylamino]butanoic acid

Systemtic Name: 4-azanyl-4-oxidanylidene-2-[3-(phenylcarbonylsulfanyl)propanoylamino]butanoic acid Openeye Name: 4-amino-2-(3-benzoylsulfanylpropanoylamino)-4-oxo-butanoic acid CAS Name: 4-amino-2-[[3-(benzoylthio)-1-oxopropyl]amino]-4-oxobutanoic acid IUPAC Name: 4-amino-2-(3-benzoylsulfanylpropanoylamino)-4-oxobutanoic acid Traditional Name: 4-amino-2-[3-(benzoylthio)propanoylamino]-4-keto-butyric acid Formula: C14H16N2O5S MolecularWeight: 324.35224

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16N2O5S/c15-11(17)8-10(13(19)20)16-12(18)6-7-22-14(21)9-4-2-1-3-5-9/h1-5,10H,6-8H2,(H2,15,17)(H,16,18)(H,19,20)