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

Systemtic Name: 5-(hydroxymethyl)-3-methyl-2-[6-[(phenylmethyl)amino]purin-9-yl]oxolane-3,4-diol Openeye Name: 2-[6-(benzylamino)purin-9-yl]-5-(hydroxymethyl)-3-methyl-tetrahydrofuran-3,4-diol CAS Name: 5-(hydroxymethyl)-3-methyl-2-[6-[(phenylmethyl)amino]-9-purinyl]oxolane-3,4-diol IUPAC Name: 2-[6-(benzylamino)purin-9-yl]-5-(hydroxymethyl)-3-methyloxolane-3,4-diol Traditional Name: 2-[6-(benzylamino)purin-9-yl]-3-methyl-5-methylol-tetrahydrofuran-3,4-diol Formula: C18H21N5O4 MolecularWeight: 371.39044

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(OC1N2C=NC3=C2N=CN=C3NCC4=CC=CC=C4)CO)O)O

Isomeric SMILES

CC1(C(C(OC1N2C=NC3=C2N=CN=C3NCC4=CC=CC=C4)CO)O)O

InChI

InChI=1S/C18H21N5O4/c1-18(26)14(25)12(8-24)27-17(18)23-10-22-13-15(20-9-21-16(13)23)19-7-11-5-3-2-4-6-11/h2-6,9-10,12,14,17,24-26H,7-8H2,1H3,(H,19,20,21)