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

Systemtic Name: 4-[(5-methyl-1H-pyrazol-3-yl)amino]-2-propan-2-yl-7-(pyridin-3-ylmethoxymethyl)phthalazin-1-one Openeye Name: 2-isopropyl-4-[(5-methyl-1H-pyrazol-3-yl)amino]-7-(3-pyridylmethoxymethyl)phthalazin-1-one CAS Name: 4-[(5-methyl-1H-pyrazol-3-yl)amino]-2-propan-2-yl-7-(3-pyridinylmethoxymethyl)-1-phthalazinone IUPAC Name: 4-[(5-methyl-1H-pyrazol-3-yl)amino]-2-propan-2-yl-7-(pyridin-3-ylmethoxymethyl)phthalazin-1-one Traditional Name: 2-isopropyl-4-[(5-methyl-1H-pyrazol-3-yl)amino]-7-(3-pyridylmethoxymethyl)phthalazin-1-one Formula: C22H24N6O2 MolecularWeight: 404.46496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1)NC2=NN(C(=O)C3=C2C=CC(=C3)COCC4=CN=CC=C4)C(C)C

Isomeric SMILES

CC1=CC(=NN1)NC2=NN(C(=O)C3=C2C=CC(=C3)COCC4=CN=CC=C4)C(C)C

InChI

InChI=1S/C22H24N6O2/c1-14(2)28-22(29)19-10-16(12-30-13-17-5-4-8-23-11-17)6-7-18(19)21(27-28)24-20-9-15(3)25-26-20/h4-11,14H,12-13H2,1-3H3,(H2,24,25,26,27)