N8-naphthalen-2-yl-9-(4-phenoxyphenyl)-N6-(phenylmethyl)purine-6,8-diamine

Systemtic Name: N8-naphthalen-2-yl-9-(4-phenoxyphenyl)-N6-(phenylmethyl)purine-6,8-diamine Openeye Name: N6-benzyl-N8-(2-naphthyl)-9-(4-phenoxyphenyl)purine-6,8-diamine CAS Name: N8-(2-naphthalenyl)-9-(4-phenoxyphenyl)-N6-(phenylmethyl)purine-6,8-diamine IUPAC Name: 6-N-benzyl-8-N-naphthalen-2-yl-9-(4-phenoxyphenyl)purine-6,8-diamine Traditional Name: benzyl-[8-(2-naphthylamino)-9-(4-phenoxyphenyl)purin-6-yl]amine Formula: C34H26N6O MolecularWeight: 534.60984

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NC=NC3=C2N=C(N3C4=CC=C(C=C4)OC5=CC=CC=C5)NC6=CC7=CC=CC=C7C=C6

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NC=NC3=C2N=C(N3C4=CC=C(C=C4)OC5=CC=CC=C5)NC6=CC7=CC=CC=C7C=C6

InChI

InChI=1S/C34H26N6O/c1-3-9-24(10-4-1)22-35-32-31-33(37-23-36-32)40(28-17-19-30(20-18-28)41-29-13-5-2-6-14-29)34(39-31)38-27-16-15-25-11-7-8-12-26(25)21-27/h1-21,23H,22H2,(H,38,39)(H,35,36,37)