4,5-dihydro-2H-benzo[g]indazol-3-yl-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: 4,5-dihydro-2H-benzo[g]indazol-3-yl-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: 4,5-dihydro-2H-benzo[g]indazol-3-yl-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: 4,5-dihydro-2H-benzo[g]indazol-3-yl-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: 4,5-dihydro-2H-benzo[g]indazol-3-yl-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: 4,5-dihydro-2H-benz[g]indazol-3-yl-[4-(2-pyrimidyl)piperazino]methanone Formula: C20H20N6O MolecularWeight: 360.4124

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(NN=C2C3=CC=CC=C31)C(=O)N4CCN(CC4)C5=NC=CC=N5

Isomeric SMILES

C1CC2=C(NN=C2C3=CC=CC=C31)C(=O)N4CCN(CC4)C5=NC=CC=N5

InChI

InChI=1S/C20H20N6O/c27-19(25-10-12-26(13-11-25)20-21-8-3-9-22-20)18-16-7-6-14-4-1-2-5-15(14)17(16)23-24-18/h1-5,8-9H,6-7,10-13H2,(H,23,24)