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

Systemtic Name: N-[(2S)-butan-2-yl]-1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: N-[(1S)-1-methylpropyl]-1-(p-tolyl)pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: N-[(2S)-butan-2-yl]-1-(4-methylphenyl)-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: N-[(2S)-butan-2-yl]-1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [(1S)-1-methylpropyl]-[1-(p-tolyl)pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C16H19N5 MolecularWeight: 281.35556

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC1=NC=NC2=C1C=NN2C3=CC=C(C=C3)C

Isomeric SMILES

CC[C@H](C)NC1=NC=NC2=C1C=NN2C3=CC=C(C=C3)C

InChI

InChI=1S/C16H19N5/c1-4-12(3)20-15-14-9-19-21(16(14)18-10-17-15)13-7-5-11(2)6-8-13/h5-10,12H,4H2,1-3H3,(H,17,18,20)/t12-/m0/s1