3-methyl-4-oxidanylidene-N-[(2-pyrazol-1-ylpyridin-4-yl)methyl]phthalazine-1-carboxamide

Systemtic Name: 3-methyl-4-oxidanylidene-N-[(2-pyrazol-1-ylpyridin-4-yl)methyl]phthalazine-1-carboxamide Openeye Name: 3-methyl-4-oxo-N-[(2-pyrazol-1-yl-4-pyridyl)methyl]phthalazine-1-carboxamide CAS Name: 3-methyl-4-oxo-N-[[2-(1-pyrazolyl)-4-pyridinyl]methyl]-1-phthalazinecarboxamide IUPAC Name: 3-methyl-4-oxo-N-[(2-pyrazol-1-ylpyridin-4-yl)methyl]phthalazine-1-carboxamide Traditional Name: 4-keto-3-methyl-N-[(2-pyrazol-1-yl-4-pyridyl)methyl]phthalazine-1-carboxamide Formula: C19H16N6O2 MolecularWeight: 360.36934

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC3=CC(=NC=C3)N4C=CC=N4

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC3=CC(=NC=C3)N4C=CC=N4

InChI

InChI=1S/C19H16N6O2/c1-24-19(27)15-6-3-2-5-14(15)17(23-24)18(26)21-12-13-7-9-20-16(11-13)25-10-4-8-22-25/h2-11H,12H2,1H3,(H,21,26)