4-[(5-methyl-1H-pyrazol-3-yl)amino]-2-propan-2-yl-7-(pyridin-4-ylmethoxy)phthalazin-1-one

Systemtic Name: 4-[(5-methyl-1H-pyrazol-3-yl)amino]-2-propan-2-yl-7-(pyridin-4-ylmethoxy)phthalazin-1-one Openeye Name: 2-isopropyl-4-[(5-methyl-1H-pyrazol-3-yl)amino]-7-(4-pyridylmethoxy)phthalazin-1-one CAS Name: 4-[(5-methyl-1H-pyrazol-3-yl)amino]-2-propan-2-yl-7-(pyridin-4-ylmethoxy)-1-phthalazinone IUPAC Name: 4-[(5-methyl-1H-pyrazol-3-yl)amino]-2-propan-2-yl-7-(pyridin-4-ylmethoxy)phthalazin-1-one Traditional Name: 2-isopropyl-4-[(5-methyl-1H-pyrazol-3-yl)amino]-7-(4-pyridylmethoxy)phthalazin-1-one Formula: C21H22N6O2 MolecularWeight: 390.43838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1)NC2=NN(C(=O)C3=C2C=CC(=C3)OCC4=CC=NC=C4)C(C)C

Isomeric SMILES

CC1=CC(=NN1)NC2=NN(C(=O)C3=C2C=CC(=C3)OCC4=CC=NC=C4)C(C)C

InChI

InChI=1S/C21H22N6O2/c1-13(2)27-21(28)18-11-16(29-12-15-6-8-22-9-7-15)4-5-17(18)20(26-27)23-19-10-14(3)24-25-19/h4-11,13H,12H2,1-3H3,(H2,23,24,25,26)