(2S)-2-[[(2S)-2-(4-oxidanylidenequinazolin-3-yl)-2-phenyl-ethanoyl]amino]-3-phenyl-propanoate

Systemtic Name: (2S)-2-[[(2S)-2-(4-oxidanylidenequinazolin-3-yl)-2-phenyl-ethanoyl]amino]-3-phenyl-propanoate Openeye Name: (2S)-2-[[(2S)-2-(4-oxoquinazolin-3-yl)-2-phenyl-acetyl]amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[(2S)-1-oxo-2-(4-oxo-3-quinazolinyl)-2-phenylethyl]amino]-3-phenylpropanoate IUPAC Name: (2S)-2-[[(2S)-2-(4-oxoquinazolin-3-yl)-2-phenylacetyl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[[(2S)-2-(4-ketoquinazolin-3-yl)-2-phenyl-acetyl]amino]-3-phenyl-propionate Formula: C25H20N3O4- MolecularWeight: 426.444

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)[O-])NC(=O)C(C2=CC=CC=C2)N3C=NC4=CC=CC=C4C3=O

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)[O-])NC(=O)[C@H](C2=CC=CC=C2)N3C=NC4=CC=CC=C4C3=O

InChI

InChI=1S/C25H21N3O4/c29-23(27-21(25(31)32)15-17-9-3-1-4-10-17)22(18-11-5-2-6-12-18)28-16-26-20-14-8-7-13-19(20)24(28)30/h1-14,16,21-22H,15H2,(H,27,29)(H,31,32)/p-1/t21-,22-/m0/s1