2-methyl-3-[[9-propan-2-yl-6-(pyridin-2-ylmethylamino)-2H-purin-3-yl]amino]pentan-2-ol

Systemtic Name: 2-methyl-3-[[9-propan-2-yl-6-(pyridin-2-ylmethylamino)-2H-purin-3-yl]amino]pentan-2-ol Openeye Name: 3-[[9-isopropyl-6-(2-pyridylmethylamino)-2H-purin-3-yl]amino]-2-methyl-pentan-2-ol CAS Name: 2-methyl-3-[[9-propan-2-yl-6-(2-pyridinylmethylamino)-2H-purin-3-yl]amino]-2-pentanol IUPAC Name: 2-methyl-3-[[9-propan-2-yl-6-(pyridin-2-ylmethylamino)-2H-purin-3-yl]amino]pentan-2-ol Traditional Name: 3-[[9-isopropyl-6-(2-pyridylmethylamino)-2H-purin-3-yl]amino]-2-methyl-pentan-2-ol Formula: C20H31N7O MolecularWeight: 385.50644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C)(C)O)NN1CN=C(C2=C1N(C=N2)C(C)C)NCC3=CC=CC=N3

Isomeric SMILES

CCC(C(C)(C)O)NN1CN=C(C2=C1N(C=N2)C(C)C)NCC3=CC=CC=N3

InChI

InChI=1S/C20H31N7O/c1-6-16(20(4,5)28)25-27-13-24-18(22-11-15-9-7-8-10-21-15)17-19(27)26(12-23-17)14(2)3/h7-10,12,14,16,25,28H,6,11,13H2,1-5H3,(H,22,24)