4-azanyl-4-oxidanylidene-2-[2-(phenylmethylsulfanyl)ethanoylamino]butanoic acid

Systemtic Name: 4-azanyl-4-oxidanylidene-2-[2-(phenylmethylsulfanyl)ethanoylamino]butanoic acid Openeye Name: 4-amino-2-[(2-benzylsulfanylacetyl)amino]-4-oxo-butanoic acid CAS Name: 4-amino-4-oxo-2-[[1-oxo-2-(phenylmethylthio)ethyl]amino]butanoic acid IUPAC Name: 4-amino-2-[(2-benzylsulfanylacetyl)amino]-4-oxobutanoic acid Traditional Name: 4-amino-2-[[2-(benzylthio)acetyl]amino]-4-keto-butyric acid Formula: C13H16N2O4S MolecularWeight: 296.34214

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N2O4S/c14-11(16)6-10(13(18)19)15-12(17)8-20-7-9-4-2-1-3-5-9/h1-5,10H,6-8H2,(H2,14,16)(H,15,17)(H,18,19)