2-[5-oxidanylidene-2-[(4,6,7-trimethylquinazolin-2-yl)amino]-1,4-dihydroimidazol-4-yl]ethanoic acid

Systemtic Name: 2-[5-oxidanylidene-2-[(4,6,7-trimethylquinazolin-2-yl)amino]-1,4-dihydroimidazol-4-yl]ethanoic acid Openeye Name: 2-[5-oxo-2-[(4,6,7-trimethylquinazolin-2-yl)amino]-1,4-dihydroimidazol-4-yl]acetic acid CAS Name: 2-[5-oxo-2-[(4,6,7-trimethyl-2-quinazolinyl)amino]-1,4-dihydroimidazol-4-yl]acetic acid IUPAC Name: 2-[5-oxo-2-[(4,6,7-trimethylquinazolin-2-yl)amino]-1,4-dihydroimidazol-4-yl]acetic acid Traditional Name: 2-[5-keto-2-[(4,6,7-trimethylquinazolin-2-yl)amino]-2-imidazolin-4-yl]acetic acid Formula: C16H17N5O3 MolecularWeight: 327.33788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=NC(=N2)NC3=NC(C(=O)N3)CC(=O)O)C)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=NC(=N2)NC3=NC(C(=O)N3)CC(=O)O)C)C

InChI

InChI=1S/C16H17N5O3/c1-7-4-10-9(3)17-15(18-11(10)5-8(7)2)21-16-19-12(6-13(22)23)14(24)20-16/h4-5,12H,6H2,1-3H3,(H,22,23)(H2,17,18,19,20,21,24)