1-ethyl-3-(furan-2-ylmethyl)-7-methyl-8-(phenylmethyl)purine-2,6-dione

Systemtic Name: 1-ethyl-3-(furan-2-ylmethyl)-7-methyl-8-(phenylmethyl)purine-2,6-dione Openeye Name: 8-benzyl-1-ethyl-3-(2-furylmethyl)-7-methyl-purine-2,6-dione CAS Name: 1-ethyl-3-(2-furanylmethyl)-7-methyl-8-(phenylmethyl)purine-2,6-dione IUPAC Name: 8-benzyl-1-ethyl-3-(furan-2-ylmethyl)-7-methylpurine-2,6-dione Traditional Name: 8-benzyl-1-ethyl-3-(2-furfuryl)-7-methyl-xanthine Formula: C20H20N4O3 MolecularWeight: 364.3978

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(N=C(N2C)CC3=CC=CC=C3)N(C1=O)CC4=CC=CO4

Isomeric SMILES

CCN1C(=O)C2=C(N=C(N2C)CC3=CC=CC=C3)N(C1=O)CC4=CC=CO4

InChI

InChI=1S/C20H20N4O3/c1-3-23-19(25)17-18(24(20(23)26)13-15-10-7-11-27-15)21-16(22(17)2)12-14-8-5-4-6-9-14/h4-11H,3,12-13H2,1-2H3