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

Systemtic Name: 4-[(5-methyl-1H-pyrazol-3-yl)amino]-2-(4-phenylazanylphenyl)phthalazin-1-one Openeye Name: 2-(4-anilinophenyl)-4-[(5-methyl-1H-pyrazol-3-yl)amino]phthalazin-1-one CAS Name: 2-(4-anilinophenyl)-4-[(5-methyl-1H-pyrazol-3-yl)amino]-1-phthalazinone IUPAC Name: 2-(4-anilinophenyl)-4-[(5-methyl-1H-pyrazol-3-yl)amino]phthalazin-1-one Traditional Name: 2-(4-anilinophenyl)-4-[(5-methyl-1H-pyrazol-3-yl)amino]phthalazin-1-one Formula: C24H20N6O MolecularWeight: 408.4552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1)NC2=NN(C(=O)C3=CC=CC=C32)C4=CC=C(C=C4)NC5=CC=CC=C5

Isomeric SMILES

CC1=CC(=NN1)NC2=NN(C(=O)C3=CC=CC=C32)C4=CC=C(C=C4)NC5=CC=CC=C5

InChI

InChI=1S/C24H20N6O/c1-16-15-22(28-27-16)26-23-20-9-5-6-10-21(20)24(31)30(29-23)19-13-11-18(12-14-19)25-17-7-3-2-4-8-17/h2-15,25H,1H3,(H2,26,27,28,29)