(2S,3R)-3-methyl-2-[[(2S)-2-(4-oxidanylidenequinazolin-3-yl)propanoyl]amino]pentanoate

Systemtic Name: (2S,3R)-3-methyl-2-[[(2S)-2-(4-oxidanylidenequinazolin-3-yl)propanoyl]amino]pentanoate Openeye Name: (2S,3R)-3-methyl-2-[[(2S)-2-(4-oxoquinazolin-3-yl)propanoyl]amino]pentanoate CAS Name: (2S,3R)-3-methyl-2-[[(2S)-1-oxo-2-(4-oxo-3-quinazolinyl)propyl]amino]pentanoate IUPAC Name: (2S,3R)-3-methyl-2-[[(2S)-2-(4-oxoquinazolin-3-yl)propanoyl]amino]pentanoate Traditional Name: (2S,3R)-2-[[(2S)-2-(4-ketoquinazolin-3-yl)propanoyl]amino]-3-methyl-valerate Formula: C17H20N3O4- MolecularWeight: 330.3584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21N3O4/c1-4-10(2)14(17(23)24)19-15(21)11(3)20-9-18-13-8-6-5-7-12(13)16(20)22/h5-11,14H,4H2,1-3H3,(H,19,21)(H,23,24)/p-1/t10-,11+,14+/m1/s1