7-[2-(ethylamino)ethyl]-1-methyl-8-(phenylmethyl)-3H-purine-2,6-dione

Systemtic Name: 7-[2-(ethylamino)ethyl]-1-methyl-8-(phenylmethyl)-3H-purine-2,6-dione Openeye Name: 8-benzyl-7-[2-(ethylamino)ethyl]-1-methyl-3H-purine-2,6-dione CAS Name: 7-[2-(ethylamino)ethyl]-1-methyl-8-(phenylmethyl)-3H-purine-2,6-dione IUPAC Name: 8-benzyl-7-[2-(ethylamino)ethyl]-1-methyl-3H-purine-2,6-dione Traditional Name: 8-benzyl-7-[2-(ethylamino)ethyl]-1-methyl-xanthine Formula: C17H21N5O2 MolecularWeight: 327.38094

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Descriptors Computed from Structure

Canonical SMILES:

CCNCCN1C(=NC2=C1C(=O)N(C(=O)N2)C)CC3=CC=CC=C3

Isomeric SMILES

CCNCCN1C(=NC2=C1C(=O)N(C(=O)N2)C)CC3=CC=CC=C3

InChI

InChI=1S/C17H21N5O2/c1-3-18-9-10-22-13(11-12-7-5-4-6-8-12)19-15-14(22)16(23)21(2)17(24)20-15/h4-8,18H,3,9-11H2,1-2H3,(H,20,24)