2-[6-azanyl-8-bromanyl-9-[(6-methylpyridin-3-yl)methyl]purin-2-yl]oxyethanol

Systemtic Name: 2-[6-azanyl-8-bromanyl-9-[(6-methylpyridin-3-yl)methyl]purin-2-yl]oxyethanol Openeye Name: 2-[6-amino-8-bromo-9-[(6-methyl-3-pyridyl)methyl]purin-2-yl]oxyethanol CAS Name: 2-[[6-amino-8-bromo-9-[(6-methyl-3-pyridinyl)methyl]-2-purinyl]oxy]ethanol IUPAC Name: 2-[6-amino-8-bromo-9-[(6-methylpyridin-3-yl)methyl]purin-2-yl]oxyethanol Traditional Name: 2-[6-amino-8-bromo-9-[(6-methyl-3-pyridyl)methyl]purin-2-yl]oxyethanol Formula: C14H15BrN6O2 MolecularWeight: 379.2119

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)CN2C3=C(C(=NC(=N3)OCCO)N)N=C2Br

Isomeric SMILES

CC1=NC=C(C=C1)CN2C3=C(C(=NC(=N3)OCCO)N)N=C2Br

InChI

InChI=1S/C14H15BrN6O2/c1-8-2-3-9(6-17-8)7-21-12-10(18-13(21)15)11(16)19-14(20-12)23-5-4-22/h2-3,6,22H,4-5,7H2,1H3,(H2,16,19,20)