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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)[O-])NC(=O)CCN1C=NC2=CC=CC=C2C1=O

Isomeric SMILES

CC[C@@H](C)[C@@H](C(=O)[O-])NC(=O)CCN1C=NC2=CC=CC=C2C1=O

InChI

InChI=1S/C17H21N3O4/c1-3-11(2)15(17(23)24)19-14(21)8-9-20-10-18-13-7-5-4-6-12(13)16(20)22/h4-7,10-11,15H,3,8-9H2,1-2H3,(H,19,21)(H,23,24)/p-1/t11-,15+/m1/s1