4-azanyl-4-oxidanylidene-2-(2-phenethylsulfanylethanoylamino)butanoic acid

Systemtic Name: 4-azanyl-4-oxidanylidene-2-(2-phenethylsulfanylethanoylamino)butanoic acid Openeye Name: 4-amino-4-oxo-2-[(2-phenethylsulfanylacetyl)amino]butanoic acid CAS Name: 4-amino-4-oxo-2-[[1-oxo-2-(phenethylthio)ethyl]amino]butanoic acid IUPAC Name: 4-amino-4-oxo-2-[(2-phenethylsulfanylacetyl)amino]butanoic acid Traditional Name: 4-amino-4-keto-2-[[2-(phenethylthio)acetyl]amino]butyric acid Formula: C14H18N2O4S MolecularWeight: 310.36872

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18N2O4S/c15-12(17)8-11(14(19)20)16-13(18)9-21-7-6-10-4-2-1-3-5-10/h1-5,11H,6-9H2,(H2,15,17)(H,16,18)(H,19,20)