N-[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[5-tert-butyl-2-(4-fluorophenyl)-3-pyrazolyl]-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C23H22FN5O2 MolecularWeight: 419.451483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C)C4=CC=C(C=C4)F

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H22FN5O2/c1-23(2,3)18-13-19(29(26-18)15-11-9-14(24)10-12-15)25-21(30)20-16-7-5-6-8-17(16)22(31)28(4)27-20/h5-13H,1-4H3,(H,25,30)