N-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methyl]-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methyl]-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyl]-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-[[3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]methyl]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-[(1-benzyl-3,5-dimethylpyrazol-4-yl)methyl]-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: N-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyl]-4-keto-3H-phthalazine-1-carboxamide Formula: C22H21N5O2 MolecularWeight: 387.43444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2)C)CNC(=O)C3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2)C)CNC(=O)C3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C22H21N5O2/c1-14-19(15(2)27(26-14)13-16-8-4-3-5-9-16)12-23-22(29)20-17-10-6-7-11-18(17)21(28)25-24-20/h3-11H,12-13H2,1-2H3,(H,23,29)(H,25,28)