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6-(2,2-diphenylethylamino)-9-(oxan-2-yl)purine-2-carbonitrile

6-(2,2-diphenylethylamino)-9-(oxan-2-yl)purine-2-carbonitrile

Systemtic Name:6-(2,2-diphenylethylamino)-9-(oxan-2-yl)purine-2-carbonitrile
Openeye Name:6-(2,2-diphenylethylamino)-9-tetrahydropyran-2-yl-purine-2-carbonitrile
CAS Name:6-(2,2-diphenylethylamino)-9-(2-oxanyl)-2-purinecarbonitrile
IUPAC Name:6-(2,2-diphenylethylamino)-9-(oxan-2-yl)purine-2-carbonitrile
Traditional Name:6-(2,2-diphenylethylamino)-9-tetrahydropyran-2-yl-purine-2-carbonitrile
Formula: C25H24N6O
MolecularWeight: 424.49766
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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)N2C=NC3=C2N=C(N=C3NCC(C4=CC=CC=C4)C5=CC=CC=C5)C#N


Isomeric SMILES

C1CCOC(C1)N2C=NC3=C2N=C(N=C3NCC(C4=CC=CC=C4)C5=CC=CC=C5)C#N


InChI

InChI=1S/C25H24N6O/c26-15-21-29-24(23-25(30-21)31(17-28-23)22-13-7-8-14-32-22)27-16-20(18-9-3-1-4-10-18)19-11-5-2-6-12-19/h1-6,9-12,17,20,22H,7-8,13-14,16H2,(H,27,29,30)


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