N-[5-methyl-2-[1-(3-methylphenyl)-4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-6-yl]pyrazol-3-yl]-4-phenyl-butanamide

Systemtic Name: N-[5-methyl-2-[1-(3-methylphenyl)-4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-6-yl]pyrazol-3-yl]-4-phenyl-butanamide Openeye Name: N-[5-methyl-2-[1-(m-tolyl)-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl]pyrazol-3-yl]-4-phenyl-butanamide CAS Name: N-[5-methyl-2-[1-(3-methylphenyl)-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl]-3-pyrazolyl]-4-phenylbutanamide IUPAC Name: N-[5-methyl-2-[1-(3-methylphenyl)-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl]pyrazol-3-yl]-4-phenylbutanamide Traditional Name: N-[2-[4-keto-1-(m-tolyl)-2H-pyrazolo[3,4-d]pyrimidin-6-yl]-5-methyl-pyrazol-3-yl]-4-phenyl-butyramide Formula: C26H25N7O2 MolecularWeight: 467.5224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C3=NC(=NC(=O)C3=CN2)N4C(=CC(=N4)C)NC(=O)CCCC5=CC=CC=C5

Isomeric SMILES

CC1=CC(=CC=C1)N2C3=NC(=NC(=O)C3=CN2)N4C(=CC(=N4)C)NC(=O)CCCC5=CC=CC=C5

InChI

InChI=1S/C26H25N7O2/c1-17-8-6-12-20(14-17)32-24-21(16-27-32)25(35)30-26(29-24)33-22(15-18(2)31-33)28-23(34)13-7-11-19-9-4-3-5-10-19/h3-6,8-10,12,14-16,27H,7,11,13H2,1-2H3,(H,28,34)