2-azanyl-3-oxidanylidene-4-[2-[(3-oxidanylidene-3-phenyl-propanethioyl)amino]ethanoylamino]butanoic acid

Systemtic Name: 2-azanyl-3-oxidanylidene-4-[2-[(3-oxidanylidene-3-phenyl-propanethioyl)amino]ethanoylamino]butanoic acid Openeye Name: 2-amino-3-oxo-4-[[2-[(3-oxo-3-phenyl-propanethioyl)amino]acetyl]amino]butanoic acid CAS Name: 2-amino-3-oxo-4-[[1-oxo-2-[(3-oxo-3-phenyl-1-sulfanylidenepropyl)amino]ethyl]amino]butanoic acid IUPAC Name: 2-amino-3-oxo-4-[[2-[(3-oxo-3-phenylpropanethioyl)amino]acetyl]amino]butanoic acid Traditional Name: 2-amino-3-keto-4-[[2-[(3-keto-3-phenyl-propanethioyl)amino]acetyl]amino]butyric acid Formula: C15H17N3O5S MolecularWeight: 351.37758

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CC(=S)NCC(=O)NCC(=O)C(C(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CC(=S)NCC(=O)NCC(=O)C(C(=O)O)N

InChI

InChI=1S/C15H17N3O5S/c16-14(15(22)23)11(20)7-17-12(21)8-18-13(24)6-10(19)9-4-2-1-3-5-9/h1-5,14H,6-8,16H2,(H,17,21)(H,18,24)(H,22,23)