2-(2-imidazol-1-ylethyl)-4-pyridin-3-yl-6-(trifluoromethyl)phthalazin-1-one

Systemtic Name: 2-(2-imidazol-1-ylethyl)-4-pyridin-3-yl-6-(trifluoromethyl)phthalazin-1-one Openeye Name: 2-(2-imidazol-1-ylethyl)-4-(3-pyridyl)-6-(trifluoromethyl)phthalazin-1-one CAS Name: 2-[2-(1-imidazolyl)ethyl]-4-(3-pyridinyl)-6-(trifluoromethyl)-1-phthalazinone IUPAC Name: 2-(2-imidazol-1-ylethyl)-4-pyridin-3-yl-6-(trifluoromethyl)phthalazin-1-one Traditional Name: 2-(2-imidazol-1-ylethyl)-4-(3-pyridyl)-6-(trifluoromethyl)phthalazin-1-one Formula: C19H14F3N5O MolecularWeight: 385.34257

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C2=NN(C(=O)C3=C2C=C(C=C3)C(F)(F)F)CCN4C=CN=C4

Isomeric SMILES

C1=CC(=CN=C1)C2=NN(C(=O)C3=C2C=C(C=C3)C(F)(F)F)CCN4C=CN=C4

InChI

InChI=1S/C19H14F3N5O/c20-19(21,22)14-3-4-15-16(10-14)17(13-2-1-5-23-11-13)25-27(18(15)28)9-8-26-7-6-24-12-26/h1-7,10-12H,8-9H2