2-(6-aminopurin-9-yl)-5-[(2-phenylpropan-2-ylamino)oxymethyl]oxolane-3,4-diol hydrochloride

Systemtic Name: 2-(6-aminopurin-9-yl)-5-[(2-phenylpropan-2-ylamino)oxymethyl]oxolane-3,4-diol hydrochloride Openeye Name: 2-(6-aminopurin-9-yl)-5-[[(1-methyl-1-phenyl-ethyl)amino]oxymethyl]tetrahydrofuran-3,4-diol hydrochloride CAS Name: 2-(6-aminopurin-9-yl)-5-[(2-phenylpropan-2-ylamino)oxymethyl]oxolane-3,4-diol hydrochloride IUPAC Name: 2-(6-aminopurin-9-yl)-5-[(2-phenylpropan-2-ylamino)oxymethyl]oxolane-3,4-diol hydrochloride Traditional Name: 2-adenin-9-yl-5-[(cumylamino)oxymethyl]tetrahydrofuran-3,4-diol hydrochloride Formula: C19H25ClN6O4 MolecularWeight: 436.8926

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC=C1)NOCC2C(C(C(O2)N3C=NC4=C3N=CN=C4N)O)O.Cl

Isomeric SMILES

CC(C)(C1=CC=CC=C1)NOCC2C(C(C(O2)N3C=NC4=C3N=CN=C4N)O)O.Cl

InChI

InChI=1S/C19H24N6O4.ClH/c1-19(2,11-6-4-3-5-7-11)24-28-8-12-14(26)15(27)18(29-12)25-10-23-13-16(20)21-9-22-17(13)25;/h3-7,9-10,12,14-15,18,24,26-27H,8H2,1-2H3,(H2,20,21,22);1H