N2-butyl-8-methoxy-9-[(4-phenylmethoxyphenyl)methyl]purine-2,6-diamine

Systemtic Name: N2-butyl-8-methoxy-9-[(4-phenylmethoxyphenyl)methyl]purine-2,6-diamine Openeye Name: 9-[(4-benzyloxyphenyl)methyl]-N2-butyl-8-methoxy-purine-2,6-diamine CAS Name: N2-butyl-8-methoxy-9-[(4-phenylmethoxyphenyl)methyl]purine-2,6-diamine IUPAC Name: 2-N-butyl-8-methoxy-9-[(4-phenylmethoxyphenyl)methyl]purine-2,6-diamine Traditional Name: [6-amino-9-(4-benzoxybenzyl)-8-methoxy-purin-2-yl]-butyl-amine Formula: C24H28N6O2 MolecularWeight: 432.51812

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC2=C(C(=N1)N)N=C(N2CC3=CC=C(C=C3)OCC4=CC=CC=C4)OC

Isomeric SMILES

CCCCNC1=NC2=C(C(=N1)N)N=C(N2CC3=CC=C(C=C3)OCC4=CC=CC=C4)OC

InChI

InChI=1S/C24H28N6O2/c1-3-4-14-26-23-28-21(25)20-22(29-23)30(24(27-20)31-2)15-17-10-12-19(13-11-17)32-16-18-8-6-5-7-9-18/h5-13H,3-4,14-16H2,1-2H3,(H3,25,26,28,29)