N-[bis(4-methoxyphenyl)-phenyl-methyl]-9-[2-(phenylmethyl)-1,2-oxazolidin-5-yl]purin-6-amine

Systemtic Name: N-[bis(4-methoxyphenyl)-phenyl-methyl]-9-[2-(phenylmethyl)-1,2-oxazolidin-5-yl]purin-6-amine Openeye Name: 9-(2-benzylisoxazolidin-5-yl)-N-[bis(4-methoxyphenyl)-phenyl-methyl]purin-6-amine CAS Name: N-[bis(4-methoxyphenyl)-phenylmethyl]-9-[2-(phenylmethyl)-5-isoxazolidinyl]-6-purinamine IUPAC Name: 9-(2-benzyl-1,2-oxazolidin-5-yl)-N-[bis(4-methoxyphenyl)-phenylmethyl]purin-6-amine Traditional Name: [9-(2-benzylisoxazolidin-5-yl)purin-6-yl]-[bis(4-methoxyphenyl)-phenyl-methyl]amine Formula: C36H34N6O3 MolecularWeight: 598.69356

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=C(C=C3)OC)NC4=NC=NC5=C4N=CN5C6CCN(O6)CC7=CC=CC=C7

Isomeric SMILES

COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=C(C=C3)OC)NC4=NC=NC5=C4N=CN5C6CCN(O6)CC7=CC=CC=C7

InChI

InChI=1S/C36H34N6O3/c1-43-30-17-13-28(14-18-30)36(27-11-7-4-8-12-27,29-15-19-31(44-2)20-16-29)40-34-33-35(38-24-37-34)42(25-39-33)32-21-22-41(45-32)23-26-9-5-3-6-10-26/h3-20,24-25,32H,21-23H2,1-2H3,(H,37,38,40)