1-(5-chloranyl-2-methyl-phenyl)-N-(4-phenylmethoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: 1-(5-chloranyl-2-methyl-phenyl)-N-(4-phenylmethoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: N-(4-benzyloxyphenyl)-1-(5-chloro-2-methyl-phenyl)pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 1-(5-chloro-2-methylphenyl)-N-(4-phenylmethoxyphenyl)-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 1-(5-chloro-2-methylphenyl)-N-(4-phenylmethoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: (4-benzoxyphenyl)-[1-(5-chloro-2-methyl-phenyl)pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C25H20ClN5O MolecularWeight: 441.9122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2C3=C(C=N2)C(=NC=N3)NC4=CC=C(C=C4)OCC5=CC=CC=C5

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2C3=C(C=N2)C(=NC=N3)NC4=CC=C(C=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C25H20ClN5O/c1-17-7-8-19(26)13-23(17)31-25-22(14-29-31)24(27-16-28-25)30-20-9-11-21(12-10-20)32-15-18-5-3-2-4-6-18/h2-14,16H,15H2,1H3,(H,27,28,30)