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

Systemtic Name: methyl (2S)-3-methyl-2-[2-(4-oxidanylidenequinazolin-3-yl)ethanoylamino]butanoate Openeye Name: methyl (2S)-3-methyl-2-[[2-(4-oxoquinazolin-3-yl)acetyl]amino]butanoate CAS Name: (2S)-3-methyl-2-[[1-oxo-2-(4-oxo-3-quinazolinyl)ethyl]amino]butanoic acid methyl ester IUPAC Name: methyl (2S)-3-methyl-2-[[2-(4-oxoquinazolin-3-yl)acetyl]amino]butanoate Traditional Name: (2S)-2-[[2-(4-ketoquinazolin-3-yl)acetyl]amino]-3-methyl-butyric acid methyl ester Formula: C16H19N3O4 MolecularWeight: 317.33976

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)NC(=O)CN1C=NC2=CC=CC=C2C1=O

Isomeric SMILES

CC(C)[C@@H](C(=O)OC)NC(=O)CN1C=NC2=CC=CC=C2C1=O

InChI

InChI=1S/C16H19N3O4/c1-10(2)14(16(22)23-3)18-13(20)8-19-9-17-12-7-5-4-6-11(12)15(19)21/h4-7,9-10,14H,8H2,1-3H3,(H,18,20)/t14-/m0/s1