8-(cyclohexylamino)-7-(2-hydroxyethyl)-3-methyl-purine-2,6-dione

Systemtic Name: 8-(cyclohexylamino)-7-(2-hydroxyethyl)-3-methyl-purine-2,6-dione Openeye Name: 8-(cyclohexylamino)-7-(2-hydroxyethyl)-3-methyl-purine-2,6-dione CAS Name: 8-(cyclohexylamino)-7-(2-hydroxyethyl)-3-methylpurine-2,6-dione IUPAC Name: 8-(cyclohexylamino)-7-(2-hydroxyethyl)-3-methylpurine-2,6-dione Traditional Name: 8-(cyclohexylamino)-7-(2-hydroxyethyl)-3-methyl-xanthine Formula: C14H21N5O3 MolecularWeight: 307.34824

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N(C(=N2)NC3CCCCC3)CCO

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N(C(=N2)NC3CCCCC3)CCO

InChI

InChI=1S/C14H21N5O3/c1-18-11-10(12(21)17-14(18)22)19(7-8-20)13(16-11)15-9-5-3-2-4-6-9/h9,20H,2-8H2,1H3,(H,15,16)(H,17,21,22)