9-(oxan-2-ylmethyl)-6-phenylmethoxy-purine-2,8-diamine

Systemtic Name: 9-(oxan-2-ylmethyl)-6-phenylmethoxy-purine-2,8-diamine Openeye Name: 6-benzyloxy-9-(tetrahydropyran-2-ylmethyl)purine-2,8-diamine CAS Name: 9-(2-oxanylmethyl)-6-phenylmethoxypurine-2,8-diamine IUPAC Name: 9-(oxan-2-ylmethyl)-6-phenylmethoxypurine-2,8-diamine Traditional Name: [2-amino-6-benzoxy-9-(tetrahydropyran-2-ylmethyl)purin-8-yl]amine Formula: C18H22N6O2 MolecularWeight: 354.40628

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)CN2C3=C(C(=NC(=N3)N)OCC4=CC=CC=C4)N=C2N

Isomeric SMILES

C1CCOC(C1)CN2C3=C(C(=NC(=N3)N)OCC4=CC=CC=C4)N=C2N

InChI

InChI=1S/C18H22N6O2/c19-17-22-15-14(16(23-17)26-11-12-6-2-1-3-7-12)21-18(20)24(15)10-13-8-4-5-9-25-13/h1-3,6-7,13H,4-5,8-11H2,(H2,20,21)(H2,19,22,23)