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

Systemtic Name: 4-[(5-methyl-1H-pyrazol-3-yl)amino]-2-(4-pyrrolidin-1-ylphenyl)phthalazin-1-one Openeye Name: 4-[(5-methyl-1H-pyrazol-3-yl)amino]-2-(4-pyrrolidin-1-ylphenyl)phthalazin-1-one CAS Name: 4-[(5-methyl-1H-pyrazol-3-yl)amino]-2-[4-(1-pyrrolidinyl)phenyl]-1-phthalazinone IUPAC Name: 4-[(5-methyl-1H-pyrazol-3-yl)amino]-2-(4-pyrrolidin-1-ylphenyl)phthalazin-1-one Traditional Name: 4-[(5-methyl-1H-pyrazol-3-yl)amino]-2-(4-pyrrolidinophenyl)phthalazin-1-one Formula: C22H22N6O MolecularWeight: 386.44968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1)NC2=NN(C(=O)C3=CC=CC=C32)C4=CC=C(C=C4)N5CCCC5

Isomeric SMILES

CC1=CC(=NN1)NC2=NN(C(=O)C3=CC=CC=C32)C4=CC=C(C=C4)N5CCCC5

InChI

InChI=1S/C22H22N6O/c1-15-14-20(25-24-15)23-21-18-6-2-3-7-19(18)22(29)28(26-21)17-10-8-16(9-11-17)27-12-4-5-13-27/h2-3,6-11,14H,4-5,12-13H2,1H3,(H2,23,24,25,26)