N4-(4-chloranyl-2-methyl-phenyl)-N6-(4-methoxyphenyl)-1-methyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine

Systemtic Name: N4-(4-chloranyl-2-methyl-phenyl)-N6-(4-methoxyphenyl)-1-methyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine Openeye Name: N4-(4-chloro-2-methyl-phenyl)-N6-(4-methoxyphenyl)-1-methyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine CAS Name: N4-(4-chloro-2-methylphenyl)-N6-(4-methoxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidine-4,6-diamine IUPAC Name: 4-N-(4-chloro-2-methylphenyl)-6-N-(4-methoxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidine-4,6-diamine Traditional Name: [4-(4-chloro-2-methyl-anilino)-1-methyl-pyrazolo[3,4-d]pyrimidin-6-yl]-(4-methoxyphenyl)amine Formula: C20H19ClN6O MolecularWeight: 394.85746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)NC2=NC(=NC3=C2C=NN3C)NC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)NC2=NC(=NC3=C2C=NN3C)NC4=CC=C(C=C4)OC

InChI

InChI=1S/C20H19ClN6O/c1-12-10-13(21)4-9-17(12)24-18-16-11-22-27(2)19(16)26-20(25-18)23-14-5-7-15(28-3)8-6-14/h4-11H,1-3H3,(H2,23,24,25,26)