4-[[6-azanyl-9-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]purin-2-yl]amino]-N-ethyl-benzamide

Systemtic Name: 4-[[6-azanyl-9-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]purin-2-yl]amino]-N-ethyl-benzamide Openeye Name: 4-[[6-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]purin-2-yl]amino]-N-ethyl-benzamide CAS Name: 4-[[6-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-2-purinyl]amino]-N-ethylbenzamide IUPAC Name: 4-[[6-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-2-yl]amino]-N-ethylbenzamide Traditional Name: 4-[[6-amino-9-(3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl)purin-2-yl]amino]-N-ethyl-benzamide Formula: C19H23N7O5 MolecularWeight: 429.42982

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC=C(C=C1)NC2=NC3=C(C(=N2)N)N=CN3C4C(C(C(O4)CO)O)O

Isomeric SMILES

CCNC(=O)C1=CC=C(C=C1)NC2=NC3=C(C(=N2)N)N=CN3C4C(C(C(O4)CO)O)O

InChI

InChI=1S/C19H23N7O5/c1-2-21-17(30)9-3-5-10(6-4-9)23-19-24-15(20)12-16(25-19)26(8-22-12)18-14(29)13(28)11(7-27)31-18/h3-6,8,11,13-14,18,27-29H,2,7H2,1H3,(H,21,30)(H3,20,23,24,25)