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

Systemtic Name: N4-(3-chloranyl-4-methoxy-phenyl)-1-methyl-N6-phenyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine Openeye Name: N4-(3-chloro-4-methoxy-phenyl)-1-methyl-N6-phenyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine CAS Name: N4-(3-chloro-4-methoxyphenyl)-1-methyl-N6-phenylpyrazolo[3,4-d]pyrimidine-4,6-diamine IUPAC Name: 4-N-(3-chloro-4-methoxyphenyl)-1-methyl-6-N-phenylpyrazolo[3,4-d]pyrimidine-4,6-diamine Traditional Name: (6-anilino-1-methyl-pyrazolo[3,4-d]pyrimidin-4-yl)-(3-chloro-4-methoxy-phenyl)amine Formula: C19H17ClN6O MolecularWeight: 380.83088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC(=N2)NC3=CC=CC=C3)NC4=CC(=C(C=C4)OC)Cl

Isomeric SMILES

CN1C2=C(C=N1)C(=NC(=N2)NC3=CC=CC=C3)NC4=CC(=C(C=C4)OC)Cl

InChI

InChI=1S/C19H17ClN6O/c1-26-18-14(11-21-26)17(22-13-8-9-16(27-2)15(20)10-13)24-19(25-18)23-12-6-4-3-5-7-12/h3-11H,1-2H3,(H2,22,23,24,25)