5-[[9-[3,4-dipentoxy-5-(pentoxymethyl)oxolan-2-yl]purin-6-yl]amino]pentanamide

Systemtic Name: 5-[[9-[3,4-dipentoxy-5-(pentoxymethyl)oxolan-2-yl]purin-6-yl]amino]pentanamide Openeye Name: 5-[[9-[3,4-dipentoxy-5-(pentoxymethyl)tetrahydrofuran-2-yl]purin-6-yl]amino]pentanamide CAS Name: 5-[[9-[3,4-dipentoxy-5-(pentoxymethyl)-2-oxolanyl]-6-purinyl]amino]pentanamide IUPAC Name: 5-[[9-[3,4-dipentoxy-5-(pentoxymethyl)oxolan-2-yl]purin-6-yl]amino]pentanamide Traditional Name: 5-[[9-[3,4-diamoxy-5-(amoxymethyl)tetrahydrofuran-2-yl]purin-6-yl]amino]valeramide Formula: C30H52N6O5 MolecularWeight: 576.77108

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOCC1C(C(C(O1)N2C=NC3=C2N=CN=C3NCCCCC(=O)N)OCCCCC)OCCCCC

Isomeric SMILES

CCCCCOCC1C(C(C(O1)N2C=NC3=C2N=CN=C3NCCCCC(=O)N)OCCCCC)OCCCCC

InChI

InChI=1S/C30H52N6O5/c1-4-7-12-17-38-20-23-26(39-18-13-8-5-2)27(40-19-14-9-6-3)30(41-23)36-22-35-25-28(33-21-34-29(25)36)32-16-11-10-15-24(31)37/h21-23,26-27,30H,4-20H2,1-3H3,(H2,31,37)(H,32,33,34)