6-(2,2-diphenylethylamino)-9-[5-(methoxymethyl)-3-oxidanyl-oxolan-2-yl]purine-2-carbonitrile

Systemtic Name: 6-(2,2-diphenylethylamino)-9-[5-(methoxymethyl)-3-oxidanyl-oxolan-2-yl]purine-2-carbonitrile Openeye Name: 6-(2,2-diphenylethylamino)-9-[3-hydroxy-5-(methoxymethyl)tetrahydrofuran-2-yl]purine-2-carbonitrile CAS Name: 6-(2,2-diphenylethylamino)-9-[3-hydroxy-5-(methoxymethyl)-2-oxolanyl]-2-purinecarbonitrile IUPAC Name: 6-(2,2-diphenylethylamino)-9-[3-hydroxy-5-(methoxymethyl)oxolan-2-yl]purine-2-carbonitrile Traditional Name: 6-(2,2-diphenylethylamino)-9-[3-hydroxy-5-(methoxymethyl)tetrahydrofuran-2-yl]purine-2-carbonitrile Formula: C26H26N6O3 MolecularWeight: 470.52304

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Descriptors Computed from Structure

Canonical SMILES:

COCC1CC(C(O1)N2C=NC3=C2N=C(N=C3NCC(C4=CC=CC=C4)C5=CC=CC=C5)C#N)O

Isomeric SMILES

COCC1CC(C(O1)N2C=NC3=C2N=C(N=C3NCC(C4=CC=CC=C4)C5=CC=CC=C5)C#N)O

InChI

InChI=1S/C26H26N6O3/c1-34-15-19-12-21(33)26(35-19)32-16-29-23-24(30-22(13-27)31-25(23)32)28-14-20(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-11,16,19-21,26,33H,12,14-15H2,1H3,(H,28,30,31)