(2S)-4-azanyl-4-oxidanylidene-2-[3-(4-oxidanylidenequinazolin-3-yl)propanoylamino]butanoate

Systemtic Name: (2S)-4-azanyl-4-oxidanylidene-2-[3-(4-oxidanylidenequinazolin-3-yl)propanoylamino]butanoate Openeye Name: (2S)-4-amino-4-oxo-2-[3-(4-oxoquinazolin-3-yl)propanoylamino]butanoate CAS Name: (2S)-4-amino-4-oxo-2-[[1-oxo-3-(4-oxo-3-quinazolinyl)propyl]amino]butanoate IUPAC Name: (2S)-4-amino-4-oxo-2-[3-(4-oxoquinazolin-3-yl)propanoylamino]butanoate Traditional Name: (2S)-4-amino-4-keto-2-[3-(4-ketoquinazolin-3-yl)propanoylamino]butyrate Formula: C15H15N4O5- MolecularWeight: 331.3034

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C=N2)CCC(=O)NC(CC(=O)N)C(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C=N2)CCC(=O)N[C@@H](CC(=O)N)C(=O)[O-]

InChI

InChI=1S/C15H16N4O5/c16-12(20)7-11(15(23)24)18-13(21)5-6-19-8-17-10-4-2-1-3-9(10)14(19)22/h1-4,8,11H,5-7H2,(H2,16,20)(H,18,21)(H,23,24)/p-1/t11-/m0/s1