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

Systemtic Name: 4-[(5-methyl-1H-pyrazol-3-yl)amino]-2-(pyridin-3-ylmethyl)phthalazin-1-one Openeye Name: 4-[(5-methyl-1H-pyrazol-3-yl)amino]-2-(3-pyridylmethyl)phthalazin-1-one CAS Name: 4-[(5-methyl-1H-pyrazol-3-yl)amino]-2-(3-pyridinylmethyl)-1-phthalazinone IUPAC Name: 4-[(5-methyl-1H-pyrazol-3-yl)amino]-2-(pyridin-3-ylmethyl)phthalazin-1-one Traditional Name: 4-[(5-methyl-1H-pyrazol-3-yl)amino]-2-(3-pyridylmethyl)phthalazin-1-one Formula: C18H16N6O MolecularWeight: 332.35924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1)NC2=NN(C(=O)C3=CC=CC=C32)CC4=CN=CC=C4

Isomeric SMILES

CC1=CC(=NN1)NC2=NN(C(=O)C3=CC=CC=C32)CC4=CN=CC=C4

InChI

InChI=1S/C18H16N6O/c1-12-9-16(22-21-12)20-17-14-6-2-3-7-15(14)18(25)24(23-17)11-13-5-4-8-19-10-13/h2-10H,11H2,1H3,(H2,20,21,22,23)