1-[2-[cyclopentyl(propan-2-yl)amino]ethyl]-3-[[6-(2,2-diphenylethylamino)-9-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]purin-2-yl]methyl]urea

Systemtic Name: 1-[2-[cyclopentyl(propan-2-yl)amino]ethyl]-3-[[6-(2,2-diphenylethylamino)-9-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]purin-2-yl]methyl]urea Openeye Name: 1-[2-[cyclopentyl(isopropyl)amino]ethyl]-3-[[9-[3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-6-(2,2-diphenylethylamino)purin-2-yl]methyl]urea CAS Name: 1-[2-[cyclopentyl(propan-2-yl)amino]ethyl]-3-[[9-[3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-6-(2,2-diphenylethylamino)-2-purinyl]methyl]urea IUPAC Name: 1-[2-[cyclopentyl(propan-2-yl)amino]ethyl]-3-[[9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-6-(2,2-diphenylethylamino)purin-2-yl]methyl]urea Traditional Name: 1-[2-[cyclopentyl(isopropyl)amino]ethyl]-3-[[9-(3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl)-6-(2,2-diphenylethylamino)purin-2-yl]methyl]urea Formula: C36H48N8O5 MolecularWeight: 672.81692

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCNC(=O)NCC1=NC2=C(C(=N1)NCC(C3=CC=CC=C3)C4=CC=CC=C4)N=CN2C5C(C(C(O5)CO)O)O)C6CCCC6

Isomeric SMILES

CC(C)N(CCNC(=O)NCC1=NC2=C(C(=N1)NCC(C3=CC=CC=C3)C4=CC=CC=C4)N=CN2C5C(C(C(O5)CO)O)O)C6CCCC6

InChI

InChI=1S/C36H48N8O5/c1-23(2)43(26-15-9-10-16-26)18-17-37-36(48)39-20-29-41-33(38-19-27(24-11-5-3-6-12-24)25-13-7-4-8-14-25)30-34(42-29)44(22-40-30)35-32(47)31(46)28(21-45)49-35/h3-8,11-14,22-23,26-28,31-32,35,45-47H,9-10,15-21H2,1-2H3,(H2,37,39,48)(H,38,41,42)