(2S)-3-methyl-2-[[(2S)-3-methyl-2-(4-oxidanylidenequinazolin-3-yl)butanoyl]amino]butanoate

Systemtic Name: (2S)-3-methyl-2-[[(2S)-3-methyl-2-(4-oxidanylidenequinazolin-3-yl)butanoyl]amino]butanoate Openeye Name: (2S)-3-methyl-2-[[(2S)-3-methyl-2-(4-oxoquinazolin-3-yl)butanoyl]amino]butanoate CAS Name: (2S)-3-methyl-2-[[(2S)-3-methyl-1-oxo-2-(4-oxo-3-quinazolinyl)butyl]amino]butanoate IUPAC Name: (2S)-3-methyl-2-[[(2S)-3-methyl-2-(4-oxoquinazolin-3-yl)butanoyl]amino]butanoate Traditional Name: (2S)-2-[[(2S)-2-(4-ketoquinazolin-3-yl)-3-methyl-butanoyl]amino]-3-methyl-butyrate Formula: C18H22N3O4- MolecularWeight: 344.38498

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)[O-])NC(=O)C(C(C)C)N1C=NC2=CC=CC=C2C1=O

Isomeric SMILES

CC(C)[C@@H](C(=O)[O-])NC(=O)[C@H](C(C)C)N1C=NC2=CC=CC=C2C1=O

InChI

InChI=1S/C18H23N3O4/c1-10(2)14(18(24)25)20-16(22)15(11(3)4)21-9-19-13-8-6-5-7-12(13)17(21)23/h5-11,14-15H,1-4H3,(H,20,22)(H,24,25)/p-1/t14-,15-/m0/s1