N4-(3,5-dimethylphenyl)-N6-(furan-2-ylmethyl)-1-phenyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine

Systemtic Name: N4-(3,5-dimethylphenyl)-N6-(furan-2-ylmethyl)-1-phenyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine Openeye Name: N4-(3,5-dimethylphenyl)-N6-(2-furylmethyl)-1-phenyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine CAS Name: N4-(3,5-dimethylphenyl)-N6-(2-furanylmethyl)-1-phenylpyrazolo[3,4-d]pyrimidine-4,6-diamine IUPAC Name: 4-N-(3,5-dimethylphenyl)-6-N-(furan-2-ylmethyl)-1-phenylpyrazolo[3,4-d]pyrimidine-4,6-diamine Traditional Name: [4-(3,5-dimethylanilino)-1-phenyl-pyrazolo[3,4-d]pyrimidin-6-yl]-(2-furfuryl)amine Formula: C24H22N6O MolecularWeight: 410.47108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC2=NC(=NC3=C2C=NN3C4=CC=CC=C4)NCC5=CC=CO5)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC2=NC(=NC3=C2C=NN3C4=CC=CC=C4)NCC5=CC=CO5)C

InChI

InChI=1S/C24H22N6O/c1-16-11-17(2)13-18(12-16)27-22-21-15-26-30(19-7-4-3-5-8-19)23(21)29-24(28-22)25-14-20-9-6-10-31-20/h3-13,15H,14H2,1-2H3,(H2,25,27,28,29)