8-(cyclohexylamino)-3-methyl-7-[(2R)-2-oxidanylpropyl]purine-2,6-dione

Systemtic Name: 8-(cyclohexylamino)-3-methyl-7-[(2R)-2-oxidanylpropyl]purine-2,6-dione Openeye Name: 8-(cyclohexylamino)-7-[(2R)-2-hydroxypropyl]-3-methyl-purine-2,6-dione CAS Name: 8-(cyclohexylamino)-7-[(2R)-2-hydroxypropyl]-3-methylpurine-2,6-dione IUPAC Name: 8-(cyclohexylamino)-7-[(2R)-2-hydroxypropyl]-3-methylpurine-2,6-dione Traditional Name: 8-(cyclohexylamino)-7-[(2R)-2-hydroxypropyl]-3-methyl-xanthine Formula: C15H23N5O3 MolecularWeight: 321.37482

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C2=C(N=C1NC3CCCCC3)N(C(=O)NC2=O)C)O

Isomeric SMILES

C[C@H](CN1C2=C(N=C1NC3CCCCC3)N(C(=O)NC2=O)C)O

InChI

InChI=1S/C15H23N5O3/c1-9(21)8-20-11-12(19(2)15(23)18-13(11)22)17-14(20)16-10-6-4-3-5-7-10/h9-10,21H,3-8H2,1-2H3,(H,16,17)(H,18,22,23)/t9-/m1/s1