2-[(4-methylquinazolin-2-yl)amino]-1,4-dihydroimidazol-3-ium-5-one

Systemtic Name: 2-[(4-methylquinazolin-2-yl)amino]-1,4-dihydroimidazol-3-ium-5-one Openeye Name: 2-[(4-methylquinazolin-2-yl)amino]-1,4-dihydroimidazol-3-ium-5-one CAS Name: 2-[(4-methyl-2-quinazolinyl)amino]-1,4-dihydroimidazol-3-ium-5-one IUPAC Name: 2-[(4-methylquinazolin-2-yl)amino]-1,4-dihydroimidazol-3-ium-5-one Traditional Name: 2-[(4-methylquinazolin-2-yl)amino]-2-imidazolin-1-ium-4-one Formula: C12H12N5O+ MolecularWeight: 242.25658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC2=CC=CC=C12)NC3=[NH+]CC(=O)N3

Isomeric SMILES

CC1=NC(=NC2=CC=CC=C12)NC3=[NH+]CC(=O)N3

InChI

InChI=1S/C12H11N5O/c1-7-8-4-2-3-5-9(8)15-12(14-7)17-11-13-6-10(18)16-11/h2-5H,6H2,1H3,(H2,13,14,15,16,17,18)/p+1