N-[(4-methylphenyl)methyl]-1-(oxan-2-yl)pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: N-[(4-methylphenyl)methyl]-1-(oxan-2-yl)pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: N-(p-tolylmethyl)-1-tetrahydropyran-2-yl-pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: N-[(4-methylphenyl)methyl]-1-(2-oxanyl)-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: N-[(4-methylphenyl)methyl]-1-(oxan-2-yl)pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: (4-methylbenzyl)-(1-tetrahydropyran-2-ylpyrazolo[3,4-d]pyrimidin-4-yl)amine Formula: C18H21N5O MolecularWeight: 323.39224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC2=NC=NC3=C2C=NN3C4CCCCO4

Isomeric SMILES

CC1=CC=C(C=C1)CNC2=NC=NC3=C2C=NN3C4CCCCO4

InChI

InChI=1S/C18H21N5O/c1-13-5-7-14(8-6-13)10-19-17-15-11-22-23(18(15)21-12-20-17)16-4-2-3-9-24-16/h5-8,11-12,16H,2-4,9-10H2,1H3,(H,19,20,21)