cyclobutyl-[6,6-di(pyrimidin-4-yl)-1,7-dihydroindazol-3-yl]methanone

Systemtic Name: cyclobutyl-[6,6-di(pyrimidin-4-yl)-1,7-dihydroindazol-3-yl]methanone Openeye Name: cyclobutyl-[6,6-di(pyrimidin-4-yl)-1,7-dihydroindazol-3-yl]methanone CAS Name: [6,6-bis(4-pyrimidinyl)-1,7-dihydroindazol-3-yl]-cyclobutylmethanone IUPAC Name: cyclobutyl-[6,6-di(pyrimidin-4-yl)-1,7-dihydroindazol-3-yl]methanone Traditional Name: [6,6-bis(4-pyrimidyl)-1,7-dihydroindazol-3-yl]-cyclobutyl-methanone Formula: C20H18N6O MolecularWeight: 358.39652

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)C(=O)C2=NNC3=C2C=CC(C3)(C4=NC=NC=C4)C5=NC=NC=C5

Isomeric SMILES

C1CC(C1)C(=O)C2=NNC3=C2C=CC(C3)(C4=NC=NC=C4)C5=NC=NC=C5

InChI

InChI=1S/C20H18N6O/c27-19(13-2-1-3-13)18-14-4-7-20(10-15(14)25-26-18,16-5-8-21-11-23-16)17-6-9-22-12-24-17/h4-9,11-13H,1-3,10H2,(H,25,26)