[(2S)-1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 3-(4-oxidanylidene-1H-quinazolin-2-yl)propanoate

Systemtic Name: [(2S)-1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 3-(4-oxidanylidene-1H-quinazolin-2-yl)propanoate Openeye Name: [(1S)-1-allophanoyl-2-methyl-propyl] 3-(4-oxo-1H-quinazolin-2-yl)propanoate CAS Name: 3-(4-oxo-1H-quinazolin-2-yl)propanoic acid [(2S)-1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] ester IUPAC Name: [(2S)-1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] 3-(4-oxo-1H-quinazolin-2-yl)propanoate Traditional Name: 3-(4-keto-1H-quinazolin-2-yl)propionic acid [(1S)-1-allophanoyl-2-methyl-propyl] ester Formula: C17H20N4O5 MolecularWeight: 360.3645

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(=O)N)OC(=O)CCC1=NC(=O)C2=CC=CC=C2N1

Isomeric SMILES

CC(C)[C@@H](C(=O)NC(=O)N)OC(=O)CCC1=NC(=O)C2=CC=CC=C2N1

InChI

InChI=1S/C17H20N4O5/c1-9(2)14(16(24)21-17(18)25)26-13(22)8-7-12-19-11-6-4-3-5-10(11)15(23)20-12/h3-6,9,14H,7-8H2,1-2H3,(H,19,20,23)(H3,18,21,24,25)/t14-/m0/s1