8-[2-(2-hydroxyethyloxy)ethylamino]-1,3-dimethyl-7-[(2-methylphenyl)methyl]purine-2,6-dione

Systemtic Name: 8-[2-(2-hydroxyethyloxy)ethylamino]-1,3-dimethyl-7-[(2-methylphenyl)methyl]purine-2,6-dione Openeye Name: 8-[2-(2-hydroxyethoxy)ethylamino]-1,3-dimethyl-7-(o-tolylmethyl)purine-2,6-dione CAS Name: 8-[2-(2-hydroxyethoxy)ethylamino]-1,3-dimethyl-7-[(2-methylphenyl)methyl]purine-2,6-dione IUPAC Name: 8-[2-(2-hydroxyethoxy)ethylamino]-1,3-dimethyl-7-[(2-methylphenyl)methyl]purine-2,6-dione Traditional Name: 8-[2-(2-hydroxyethoxy)ethylamino]-1,3-dimethyl-7-(2-methylbenzyl)xanthine Formula: C19H25N5O4 MolecularWeight: 387.4329

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C3=C(N=C2NCCOCCO)N(C(=O)N(C3=O)C)C

Isomeric SMILES

CC1=CC=CC=C1CN2C3=C(N=C2NCCOCCO)N(C(=O)N(C3=O)C)C

InChI

InChI=1S/C19H25N5O4/c1-13-6-4-5-7-14(13)12-24-15-16(22(2)19(27)23(3)17(15)26)21-18(24)20-8-10-28-11-9-25/h4-7,25H,8-12H2,1-3H3,(H,20,21)