N4-(3-chlorophenyl)-N3-methyl-N3-pyridin-3-yl-1H-pyrazolo[3,4-d]pyrimidine-3,4-diamine

Systemtic Name: N4-(3-chlorophenyl)-N3-methyl-N3-pyridin-3-yl-1H-pyrazolo[3,4-d]pyrimidine-3,4-diamine Openeye Name: N4-(3-chlorophenyl)-N3-methyl-N3-(3-pyridyl)-1H-pyrazolo[3,4-d]pyrimidine-3,4-diamine CAS Name: N4-(3-chlorophenyl)-N3-methyl-N3-(3-pyridinyl)-1H-pyrazolo[3,4-d]pyrimidine-3,4-diamine IUPAC Name: 4-N-(3-chlorophenyl)-3-N-methyl-3-N-pyridin-3-yl-1H-pyrazolo[3,4-d]pyrimidine-3,4-diamine Traditional Name: [4-(3-chloroanilino)-1H-pyrazolo[3,4-d]pyrimidin-3-yl]-methyl-(3-pyridyl)amine Formula: C17H14ClN7 MolecularWeight: 351.79296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CN=CC=C1)C2=NNC3=C2C(=NC=N3)NC4=CC(=CC=C4)Cl

Isomeric SMILES

CN(C1=CN=CC=C1)C2=NNC3=C2C(=NC=N3)NC4=CC(=CC=C4)Cl

InChI

InChI=1S/C17H14ClN7/c1-25(13-6-3-7-19-9-13)17-14-15(20-10-21-16(14)23-24-17)22-12-5-2-4-11(18)8-12/h2-10H,1H3,(H2,20,21,22,23,24)