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

Systemtic Name: 9-[(2R,3S)-1-(3-ethenylphenyl)-3-phenylmethoxy-butan-2-yl]purin-6-amine Openeye Name: 9-[(1R,2S)-2-benzyloxy-1-[(3-vinylphenyl)methyl]propyl]purin-6-amine CAS Name: 9-[(2R,3S)-1-(3-ethenylphenyl)-3-phenylmethoxybutan-2-yl]-6-purinamine IUPAC Name: 9-[(2R,3S)-1-(3-ethenylphenyl)-3-phenylmethoxybutan-2-yl]purin-6-amine Traditional Name: [9-[(1R,2S)-2-benzoxy-1-(3-vinylbenzyl)propyl]purin-6-yl]amine Formula: C24H25N5O MolecularWeight: 399.4882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(CC1=CC=CC(=C1)C=C)N2C=NC3=C2N=CN=C3N)OCC4=CC=CC=C4

Isomeric SMILES

C[C@@H]([C@@H](CC1=CC=CC(=C1)C=C)N2C=NC3=C2N=CN=C3N)OCC4=CC=CC=C4

InChI

InChI=1S/C24H25N5O/c1-3-18-10-7-11-20(12-18)13-21(17(2)30-14-19-8-5-4-6-9-19)29-16-28-22-23(25)26-15-27-24(22)29/h3-12,15-17,21H,1,13-14H2,2H3,(H2,25,26,27)/t17-,21+/m0/s1