6-(1H-indazol-4-yl)-1-methyl-4-(3-pyridin-4-ylpropoxy)pyrazolo[3,4-d]pyrimidine

Systemtic Name: 6-(1H-indazol-4-yl)-1-methyl-4-(3-pyridin-4-ylpropoxy)pyrazolo[3,4-d]pyrimidine Openeye Name: 6-(1H-indazol-4-yl)-1-methyl-4-[3-(4-pyridyl)propoxy]pyrazolo[3,4-d]pyrimidine CAS Name: 6-(1H-indazol-4-yl)-1-methyl-4-(3-pyridin-4-ylpropoxy)pyrazolo[3,4-d]pyrimidine IUPAC Name: 6-(1H-indazol-4-yl)-1-methyl-4-(3-pyridin-4-ylpropoxy)pyrazolo[3,4-d]pyrimidine Traditional Name: 6-(1H-indazol-4-yl)-1-methyl-4-[3-(4-pyridyl)propoxy]pyrazolo[3,4-d]pyrimidine Formula: C21H19N7O MolecularWeight: 385.42186

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC(=N2)C3=C4C=NNC4=CC=C3)OCCCC5=CC=NC=C5

Isomeric SMILES

CN1C2=C(C=N1)C(=NC(=N2)C3=C4C=NNC4=CC=C3)OCCCC5=CC=NC=C5

InChI

InChI=1S/C21H19N7O/c1-28-20-17(13-24-28)21(29-11-3-4-14-7-9-22-10-8-14)26-19(25-20)15-5-2-6-18-16(15)12-23-27-18/h2,5-10,12-13H,3-4,11H2,1H3,(H,23,27)