9-(5-ethyl-2,4,5-trimethyl-oxolan-2-yl)-N-(3-imidazol-1-ylpropyl)-2-methyl-purin-6-amine

Systemtic Name: 9-(5-ethyl-2,4,5-trimethyl-oxolan-2-yl)-N-(3-imidazol-1-ylpropyl)-2-methyl-purin-6-amine Openeye Name: 9-(5-ethyl-2,4,5-trimethyl-tetrahydrofuran-2-yl)-N-(3-imidazol-1-ylpropyl)-2-methyl-purin-6-amine CAS Name: 9-(5-ethyl-2,4,5-trimethyl-2-oxolanyl)-N-[3-(1-imidazolyl)propyl]-2-methyl-6-purinamine IUPAC Name: 9-(5-ethyl-2,4,5-trimethyloxolan-2-yl)-N-(3-imidazol-1-ylpropyl)-2-methylpurin-6-amine Traditional Name: [9-(5-ethyl-2,4,5-trimethyl-tetrahydrofuran-2-yl)-2-methyl-purin-6-yl]-(3-imidazol-1-ylpropyl)amine Formula: C21H31N7O MolecularWeight: 397.51714

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(CC(O1)(C)N2C=NC3=C2N=C(N=C3NCCCN4C=CN=C4)C)C)C

Isomeric SMILES

CCC1(C(CC(O1)(C)N2C=NC3=C2N=C(N=C3NCCCN4C=CN=C4)C)C)C

InChI

InChI=1S/C21H31N7O/c1-6-20(4)15(2)12-21(5,29-20)28-14-24-17-18(25-16(3)26-19(17)28)23-8-7-10-27-11-9-22-13-27/h9,11,13-15H,6-8,10,12H2,1-5H3,(H,23,25,26)