N4-(4-fluorophenyl)-N6-(2-methoxyethyl)-1-phenyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine

Systemtic Name: N4-(4-fluorophenyl)-N6-(2-methoxyethyl)-1-phenyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine Openeye Name: N4-(4-fluorophenyl)-N6-(2-methoxyethyl)-1-phenyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine CAS Name: N4-(4-fluorophenyl)-N6-(2-methoxyethyl)-1-phenylpyrazolo[3,4-d]pyrimidine-4,6-diamine IUPAC Name: 4-N-(4-fluorophenyl)-6-N-(2-methoxyethyl)-1-phenylpyrazolo[3,4-d]pyrimidine-4,6-diamine Traditional Name: [4-(4-fluoroanilino)-1-phenyl-pyrazolo[3,4-d]pyrimidin-6-yl]-(2-methoxyethyl)amine Formula: C20H19FN6O MolecularWeight: 378.402863

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=NC2=C(C=NN2C3=CC=CC=C3)C(=N1)NC4=CC=C(C=C4)F

Isomeric SMILES

COCCNC1=NC2=C(C=NN2C3=CC=CC=C3)C(=N1)NC4=CC=C(C=C4)F

InChI

InChI=1S/C20H19FN6O/c1-28-12-11-22-20-25-18(24-15-9-7-14(21)8-10-15)17-13-23-27(19(17)26-20)16-5-3-2-4-6-16/h2-10,13H,11-12H2,1H3,(H2,22,24,25,26)