7-(2-ethoxyethyl)-1,3-dimethyl-8-[[(4-methylphenyl)amino]methyl]purine-2,6-dione

Systemtic Name: 7-(2-ethoxyethyl)-1,3-dimethyl-8-[[(4-methylphenyl)amino]methyl]purine-2,6-dione Openeye Name: 7-(2-ethoxyethyl)-1,3-dimethyl-8-[(4-methylanilino)methyl]purine-2,6-dione CAS Name: 7-(2-ethoxyethyl)-1,3-dimethyl-8-[(4-methylanilino)methyl]purine-2,6-dione IUPAC Name: 7-(2-ethoxyethyl)-1,3-dimethyl-8-[(4-methylanilino)methyl]purine-2,6-dione Traditional Name: 7-(2-ethoxyethyl)-1,3-dimethyl-8-(p-toluidinomethyl)xanthine Formula: C19H25N5O3 MolecularWeight: 371.4335

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C(=NC2=C1C(=O)N(C(=O)N2C)C)CNC3=CC=C(C=C3)C

Isomeric SMILES

CCOCCN1C(=NC2=C1C(=O)N(C(=O)N2C)C)CNC3=CC=C(C=C3)C

InChI

InChI=1S/C19H25N5O3/c1-5-27-11-10-24-15(12-20-14-8-6-13(2)7-9-14)21-17-16(24)18(25)23(4)19(26)22(17)3/h6-9,20H,5,10-12H2,1-4H3