[4-(6-cyclopropyl-3-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]-(4-methylphenyl)methanone

Systemtic Name: [4-(6-cyclopropyl-3-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]-(4-methylphenyl)methanone Openeye Name: [4-(6-cyclopropyl-3-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]-(p-tolyl)methanone CAS Name: [4-(6-cyclopropyl-3-methyl-1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)-1-piperazinyl]-(4-methylphenyl)methanone IUPAC Name: [4-(6-cyclopropyl-3-methyl-1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]-(4-methylphenyl)methanone Traditional Name: [4-(6-cyclopropyl-3-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)piperazino]-(p-tolyl)methanone Formula: C27H28N6O MolecularWeight: 452.55082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC(=NC4=C3C(=NN4C5=CC=CC=C5)C)C6CC6

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC(=NC4=C3C(=NN4C5=CC=CC=C5)C)C6CC6

InChI

InChI=1S/C27H28N6O/c1-18-8-10-21(11-9-18)27(34)32-16-14-31(15-17-32)25-23-19(2)30-33(22-6-4-3-5-7-22)26(23)29-24(28-25)20-12-13-20/h3-11,20H,12-17H2,1-2H3