2-[6-azanyl-2,8-bis[(phenylmethyl)amino]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol

Systemtic Name: 2-[6-azanyl-2,8-bis[(phenylmethyl)amino]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Openeye Name: 2-[6-amino-2,8-bis(benzylamino)purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: 2-[6-amino-2,8-bis[(phenylmethyl)amino]-9-purinyl]-5-(hydroxymethyl)oxolane-3,4-diol IUPAC Name: 2-[6-amino-2,8-bis(benzylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Traditional Name: 2-[6-amino-2,8-bis(benzylamino)purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol Formula: C24H27N7O4 MolecularWeight: 477.51568

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NC3=C(C(=N2)N)N=C(N3C4C(C(C(O4)CO)O)O)NCC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NC3=C(C(=N2)N)N=C(N3C4C(C(C(O4)CO)O)O)NCC5=CC=CC=C5

InChI

InChI=1S/C24H27N7O4/c25-20-17-21(30-23(29-20)26-11-14-7-3-1-4-8-14)31(22-19(34)18(33)16(13-32)35-22)24(28-17)27-12-15-9-5-2-6-10-15/h1-10,16,18-19,22,32-34H,11-13H2,(H,27,28)(H3,25,26,29,30)