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

Systemtic Name: 2-(hydroxymethyl)-5-[2-phenylazanyl-6-[(phenylmethyl)amino]purin-9-yl]oxolane-3,4-diol Openeye Name: 2-[2-anilino-6-(benzylamino)purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: 2-[2-anilino-6-[(phenylmethyl)amino]-9-purinyl]-5-(hydroxymethyl)oxolane-3,4-diol IUPAC Name: 2-[2-anilino-6-(benzylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Traditional Name: 2-[2-anilino-6-(benzylamino)purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol Formula: C23H24N6O4 MolecularWeight: 448.47446

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NC(=NC3=C2N=CN3C4C(C(C(O4)CO)O)O)NC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NC(=NC3=C2N=CN3C4C(C(C(O4)CO)O)O)NC5=CC=CC=C5

InChI

InChI=1S/C23H24N6O4/c30-12-16-18(31)19(32)22(33-16)29-13-25-17-20(24-11-14-7-3-1-4-8-14)27-23(28-21(17)29)26-15-9-5-2-6-10-15/h1-10,13,16,18-19,22,30-32H,11-12H2,(H2,24,26,27,28)