2-[C-methyl-N-[N'-(4-methylquinazolin-2-yl)carbamimidoyl]carbonimidoyl]benzoate

Systemtic Name: 2-[C-methyl-N-[N'-(4-methylquinazolin-2-yl)carbamimidoyl]carbonimidoyl]benzoate Openeye Name: 2-[C-methyl-N-[N'-(4-methylquinazolin-2-yl)carbamimidoyl]carbonimidoyl]benzoate CAS Name: 2-[1-[amino-[(4-methyl-2-quinazolinyl)imino]methyl]iminoethyl]benzoate IUPAC Name: 2-[C-methyl-N-[N'-(4-methylquinazolin-2-yl)carbamimidoyl]carbonimidoyl]benzoate Traditional Name: 2-[C-methyl-N-[N'-(4-methylquinazolin-2-yl)amidino]carbonimidoyl]benzoate Formula: C19H16N5O2- MolecularWeight: 346.36264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC2=CC=CC=C12)N=C(N)N=C(C)C3=CC=CC=C3C(=O)[O-]

Isomeric SMILES

CC1=NC(=NC2=CC=CC=C12)N=C(N)N=C(C)C3=CC=CC=C3C(=O)[O-]

InChI

InChI=1S/C19H17N5O2/c1-11(13-7-3-4-9-15(13)17(25)26)21-18(20)24-19-22-12(2)14-8-5-6-10-16(14)23-19/h3-10H,1-2H3,(H,25,26)(H2,20,22,23,24)/p-1