2-(4-tert-butylphenyl)-4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]phthalazin-1-one

Systemtic Name: 2-(4-tert-butylphenyl)-4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]phthalazin-1-one Openeye Name: 2-(4-tert-butylphenyl)-4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]phthalazin-1-one CAS Name: 2-(4-tert-butylphenyl)-4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-1-phthalazinone IUPAC Name: 2-(4-tert-butylphenyl)-4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]phthalazin-1-one Traditional Name: 2-(4-tert-butylphenyl)-4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]phthalazin-1-one Formula: C24H25N5O MolecularWeight: 399.4882

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)NC4=NNC(=C4)C5CC5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)NC4=NNC(=C4)C5CC5

InChI

InChI=1S/C24H25N5O/c1-24(2,3)16-10-12-17(13-11-16)29-23(30)19-7-5-4-6-18(19)22(28-29)25-21-14-20(26-27-21)15-8-9-15/h4-7,10-15H,8-9H2,1-3H3,(H2,25,26,27,28)