(4-azanylquinazolin-2-yl)methyl 3-[[2,5-bis(oxidanylidene)imidazolidin-1-yl]methyl]benzoate

Systemtic Name: (4-azanylquinazolin-2-yl)methyl 3-[[2,5-bis(oxidanylidene)imidazolidin-1-yl]methyl]benzoate Openeye Name: (4-aminoquinazolin-2-yl)methyl 3-[(2,5-dioxoimidazolidin-1-yl)methyl]benzoate CAS Name: 3-[(2,5-dioxo-1-imidazolidinyl)methyl]benzoic acid (4-amino-2-quinazolinyl)methyl ester IUPAC Name: (4-aminoquinazolin-2-yl)methyl 3-[(2,5-dioxoimidazolidin-1-yl)methyl]benzoate Traditional Name: 3-[(2,5-diketoimidazolidin-1-yl)methyl]benzoic acid (4-aminoquinazolin-2-yl)methyl ester Formula: C20H17N5O4 MolecularWeight: 391.38008

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C(=O)N1)CC2=CC=CC(=C2)C(=O)OCC3=NC4=CC=CC=C4C(=N3)N

Isomeric SMILES

C1C(=O)N(C(=O)N1)CC2=CC=CC(=C2)C(=O)OCC3=NC4=CC=CC=C4C(=N3)N

InChI

InChI=1S/C20H17N5O4/c21-18-14-6-1-2-7-15(14)23-16(24-18)11-29-19(27)13-5-3-4-12(8-13)10-25-17(26)9-22-20(25)28/h1-8H,9-11H2,(H,22,28)(H2,21,23,24)