2-(2-imidazol-1-ylethyl)-4-pyridin-4-yl-phthalazin-1-one

Systemtic Name: 2-(2-imidazol-1-ylethyl)-4-pyridin-4-yl-phthalazin-1-one Openeye Name: 2-(2-imidazol-1-ylethyl)-4-(4-pyridyl)phthalazin-1-one CAS Name: 2-[2-(1-imidazolyl)ethyl]-4-pyridin-4-yl-1-phthalazinone IUPAC Name: 2-(2-imidazol-1-ylethyl)-4-pyridin-4-ylphthalazin-1-one Traditional Name: 2-(2-imidazol-1-ylethyl)-4-(4-pyridyl)phthalazin-1-one Formula: C18H15N5O MolecularWeight: 317.3446

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN(C2=O)CCN3C=CN=C3)C4=CC=NC=C4

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN(C2=O)CCN3C=CN=C3)C4=CC=NC=C4

InChI

InChI=1S/C18H15N5O/c24-18-16-4-2-1-3-15(16)17(14-5-7-19-8-6-14)21-23(18)12-11-22-10-9-20-13-22/h1-10,13H,11-12H2