3-(4-methylphenyl)-1-(4-morpholin-4-ylcyclohexyl)pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: 3-(4-methylphenyl)-1-(4-morpholin-4-ylcyclohexyl)pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 1-(4-morpholinocyclohexyl)-3-(p-tolyl)pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 3-(4-methylphenyl)-1-[4-(4-morpholinyl)cyclohexyl]-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 3-(4-methylphenyl)-1-(4-morpholin-4-ylcyclohexyl)pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [1-(4-morpholinocyclohexyl)-3-(p-tolyl)pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C22H28N6O MolecularWeight: 392.49732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C3=C2C(=NC=N3)N)C4CCC(CC4)N5CCOCC5

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C3=C2C(=NC=N3)N)C4CCC(CC4)N5CCOCC5

InChI

InChI=1S/C22H28N6O/c1-15-2-4-16(5-3-15)20-19-21(23)24-14-25-22(19)28(26-20)18-8-6-17(7-9-18)27-10-12-29-13-11-27/h2-5,14,17-18H,6-13H2,1H3,(H2,23,24,25)