7-(2-ethoxyethyl)-8-[(4-methoxyphenyl)methylamino]-3-methyl-purine-2,6-dione

Systemtic Name: 7-(2-ethoxyethyl)-8-[(4-methoxyphenyl)methylamino]-3-methyl-purine-2,6-dione Openeye Name: 7-(2-ethoxyethyl)-8-[(4-methoxyphenyl)methylamino]-3-methyl-purine-2,6-dione CAS Name: 7-(2-ethoxyethyl)-8-[(4-methoxyphenyl)methylamino]-3-methylpurine-2,6-dione IUPAC Name: 7-(2-ethoxyethyl)-8-[(4-methoxyphenyl)methylamino]-3-methylpurine-2,6-dione Traditional Name: 7-(2-ethoxyethyl)-3-methyl-8-(p-anisylamino)xanthine Formula: C18H23N5O4 MolecularWeight: 373.40632

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C2=C(N=C1NCC3=CC=C(C=C3)OC)N(C(=O)NC2=O)C

Isomeric SMILES

CCOCCN1C2=C(N=C1NCC3=CC=C(C=C3)OC)N(C(=O)NC2=O)C

InChI

InChI=1S/C18H23N5O4/c1-4-27-10-9-23-14-15(22(2)18(25)21-16(14)24)20-17(23)19-11-12-5-7-13(26-3)8-6-12/h5-8H,4,9-11H2,1-3H3,(H,19,20)(H,21,24,25)