2-[[9-propan-2-yl-6-(pyridin-3-ylmethylamino)purin-2-yl]amino]ethanol

Systemtic Name: 2-[[9-propan-2-yl-6-(pyridin-3-ylmethylamino)purin-2-yl]amino]ethanol Openeye Name: 2-[[9-isopropyl-6-(3-pyridylmethylamino)purin-2-yl]amino]ethanol CAS Name: 2-[[9-propan-2-yl-6-(3-pyridinylmethylamino)-2-purinyl]amino]ethanol IUPAC Name: 2-[[9-propan-2-yl-6-(pyridin-3-ylmethylamino)purin-2-yl]amino]ethanol Traditional Name: 2-[[9-isopropyl-6-(3-pyridylmethylamino)purin-2-yl]amino]ethanol Formula: C16H21N7O MolecularWeight: 327.38424

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CN=CC=C3)NCCO

Isomeric SMILES

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CN=CC=C3)NCCO

InChI

InChI=1S/C16H21N7O/c1-11(2)23-10-20-13-14(19-9-12-4-3-5-17-8-12)21-16(18-6-7-24)22-15(13)23/h3-5,8,10-11,24H,6-7,9H2,1-2H3,(H2,18,19,21,22)