9-[(2R,3S)-1-phenethyloxy-3-phenylmethoxy-butan-2-yl]purin-6-amine

Systemtic Name: 9-[(2R,3S)-1-phenethyloxy-3-phenylmethoxy-butan-2-yl]purin-6-amine Openeye Name: 9-[(1R,2S)-2-benzyloxy-1-(phenethyloxymethyl)propyl]purin-6-amine CAS Name: 9-[(2R,3S)-1-phenethyloxy-3-phenylmethoxybutan-2-yl]-6-purinamine IUPAC Name: 9-[(2R,3S)-1-phenethyloxy-3-phenylmethoxybutan-2-yl]purin-6-amine Traditional Name: [9-[(1R,2S)-2-benzoxy-1-(phenethyloxymethyl)propyl]purin-6-yl]amine Formula: C24H27N5O2 MolecularWeight: 417.50348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(COCCC1=CC=CC=C1)N2C=NC3=C2N=CN=C3N)OCC4=CC=CC=C4

Isomeric SMILES

C[C@@H]([C@@H](COCCC1=CC=CC=C1)N2C=NC3=C2N=CN=C3N)OCC4=CC=CC=C4

InChI

InChI=1S/C24H27N5O2/c1-18(31-14-20-10-6-3-7-11-20)21(15-30-13-12-19-8-4-2-5-9-19)29-17-28-22-23(25)26-16-27-24(22)29/h2-11,16-18,21H,12-15H2,1H3,(H2,25,26,27)/t18-,21+/m0/s1