(4-methyl-2-phenyl-piperazin-1-yl)-[1-(phenylmethyl)pyrazolo[3,4-b]pyridin-5-yl]methanone

Systemtic Name: (4-methyl-2-phenyl-piperazin-1-yl)-[1-(phenylmethyl)pyrazolo[3,4-b]pyridin-5-yl]methanone Openeye Name: (1-benzylpyrazolo[3,4-b]pyridin-5-yl)-(4-methyl-2-phenyl-piperazin-1-yl)methanone CAS Name: (4-methyl-2-phenyl-1-piperazinyl)-[1-(phenylmethyl)-5-pyrazolo[3,4-b]pyridinyl]methanone IUPAC Name: (1-benzylpyrazolo[3,4-b]pyridin-5-yl)-(4-methyl-2-phenylpiperazin-1-yl)methanone Traditional Name: (1-benzylpyrazolo[3,4-b]pyridin-5-yl)-(4-methyl-2-phenyl-piperazino)methanone Formula: C25H25N5O MolecularWeight: 411.4989

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(C(C1)C2=CC=CC=C2)C(=O)C3=CN=C4C(=C3)C=NN4CC5=CC=CC=C5

Isomeric SMILES

CN1CCN(C(C1)C2=CC=CC=C2)C(=O)C3=CN=C4C(=C3)C=NN4CC5=CC=CC=C5

InChI

InChI=1S/C25H25N5O/c1-28-12-13-29(23(18-28)20-10-6-3-7-11-20)25(31)22-14-21-16-27-30(24(21)26-15-22)17-19-8-4-2-5-9-19/h2-11,14-16,23H,12-13,17-18H2,1H3