[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]-(3-phenyl-1H-pyrazol-5-yl)methanone

Systemtic Name: [4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]-(3-phenyl-1H-pyrazol-5-yl)methanone Openeye Name: [4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]-(3-phenyl-1H-pyrazol-5-yl)methanone CAS Name: [4-(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)-1-piperazinyl]-(3-phenyl-1H-pyrazol-5-yl)methanone IUPAC Name: [4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]-(3-phenyl-1H-pyrazol-5-yl)methanone Traditional Name: [4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazino]-(3-phenyl-1H-pyrazol-5-yl)methanone Formula: C20H20N8O MolecularWeight: 388.4258

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC=N2)N3CCN(CC3)C(=O)C4=CC(=NN4)C5=CC=CC=C5

Isomeric SMILES

CN1C2=C(C=N1)C(=NC=N2)N3CCN(CC3)C(=O)C4=CC(=NN4)C5=CC=CC=C5

InChI

InChI=1S/C20H20N8O/c1-26-18-15(12-23-26)19(22-13-21-18)27-7-9-28(10-8-27)20(29)17-11-16(24-25-17)14-5-3-2-4-6-14/h2-6,11-13H,7-10H2,1H3,(H,24,25)