3-methyl-7-[(2-methylphenyl)methyl]-8-(morpholin-4-ylmethyl)purine-2,6-dione

Systemtic Name: 3-methyl-7-[(2-methylphenyl)methyl]-8-(morpholin-4-ylmethyl)purine-2,6-dione Openeye Name: 3-methyl-8-(morpholinomethyl)-7-(o-tolylmethyl)purine-2,6-dione CAS Name: 3-methyl-7-[(2-methylphenyl)methyl]-8-(4-morpholinylmethyl)purine-2,6-dione IUPAC Name: 3-methyl-7-[(2-methylphenyl)methyl]-8-(morpholin-4-ylmethyl)purine-2,6-dione Traditional Name: 3-methyl-7-(2-methylbenzyl)-8-(morpholinomethyl)xanthine Formula: C19H23N5O3 MolecularWeight: 369.41762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C(=NC3=C2C(=O)NC(=O)N3C)CN4CCOCC4

Isomeric SMILES

CC1=CC=CC=C1CN2C(=NC3=C2C(=O)NC(=O)N3C)CN4CCOCC4

InChI

InChI=1S/C19H23N5O3/c1-13-5-3-4-6-14(13)11-24-15(12-23-7-9-27-10-8-23)20-17-16(24)18(25)21-19(26)22(17)2/h3-6H,7-12H2,1-2H3,(H,21,25,26)