N2-[(1S)-1-(5-fluoranylpyridin-2-yl)ethyl]-7-methyl-N6-(5-methyl-1H-pyrazol-3-yl)purine-2,6-diamine

Systemtic Name: N2-[(1S)-1-(5-fluoranylpyridin-2-yl)ethyl]-7-methyl-N6-(5-methyl-1H-pyrazol-3-yl)purine-2,6-diamine Openeye Name: N2-[(1S)-1-(5-fluoro-2-pyridyl)ethyl]-7-methyl-N6-(5-methyl-1H-pyrazol-3-yl)purine-2,6-diamine CAS Name: N2-[(1S)-1-(5-fluoro-2-pyridinyl)ethyl]-7-methyl-N6-(5-methyl-1H-pyrazol-3-yl)purine-2,6-diamine IUPAC Name: 2-N-[(1S)-1-(5-fluoropyridin-2-yl)ethyl]-7-methyl-6-N-(5-methyl-1H-pyrazol-3-yl)purine-2,6-diamine Traditional Name: [(1S)-1-(5-fluoro-2-pyridyl)ethyl]-[7-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]purin-2-yl]amine Formula: C17H18FN9 MolecularWeight: 367.383523

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1)NC2=NC(=NC3=C2N(C=N3)C)NC(C)C4=NC=C(C=C4)F

Isomeric SMILES

CC1=CC(=NN1)NC2=NC(=NC3=C2N(C=N3)C)N[C@@H](C)C4=NC=C(C=C4)F

InChI

InChI=1S/C17H18FN9/c1-9-6-13(26-25-9)22-16-14-15(20-8-27(14)3)23-17(24-16)21-10(2)12-5-4-11(18)7-19-12/h4-8,10H,1-3H3,(H3,21,22,23,24,25,26)/t10-/m0/s1