3-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: 3-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: 3-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]-4-oxo-phthalazine-1-carboxylate CAS Name: 3-[(5,7-dimethyl-2-imidazo[1,2-a]pyrimidinyl)methyl]-4-oxo-1-phthalazinecarboxylate IUPAC Name: 3-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]-4-oxophthalazine-1-carboxylate Traditional Name: 3-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]-4-keto-phthalazine-1-carboxylate Formula: C18H14N5O3- MolecularWeight: 348.33546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=NC(=CN12)CN3C(=O)C4=CC=CC=C4C(=N3)C(=O)[O-])C

Isomeric SMILES

CC1=CC(=NC2=NC(=CN12)CN3C(=O)C4=CC=CC=C4C(=N3)C(=O)[O-])C

InChI

InChI=1S/C18H15N5O3/c1-10-7-11(2)22-8-12(20-18(22)19-10)9-23-16(24)14-6-4-3-5-13(14)15(21-23)17(25)26/h3-8H,9H2,1-2H3,(H,25,26)/p-1