6-(furan-2-ylmethyl)-4-methyl-2-[(4-methylphenyl)methyl]-7,8-dihydropurino[7,8-a]imidazole-1,3-dione

Systemtic Name: 6-(furan-2-ylmethyl)-4-methyl-2-[(4-methylphenyl)methyl]-7,8-dihydropurino[7,8-a]imidazole-1,3-dione Openeye Name: 6-(2-furylmethyl)-4-methyl-2-(p-tolylmethyl)-7,8-dihydropurino[7,8-a]imidazole-1,3-dione CAS Name: 6-(2-furanylmethyl)-4-methyl-2-[(4-methylphenyl)methyl]-7,8-dihydropurino[7,8-a]imidazole-1,3-dione IUPAC Name: 6-(furan-2-ylmethyl)-4-methyl-2-[(4-methylphenyl)methyl]-7,8-dihydropurino[7,8-a]imidazole-1,3-dione Traditional Name: 6-(2-furfuryl)-4-methyl-2-(4-methylbenzyl)-7,8-dihydropurin[7,8-a]imidazole-1,3-quinone Formula: C21H21N5O3 MolecularWeight: 391.42314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=O)C3=C(N=C4N3CCN4CC5=CC=CO5)N(C2=O)C

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=O)C3=C(N=C4N3CCN4CC5=CC=CO5)N(C2=O)C

InChI

InChI=1S/C21H21N5O3/c1-14-5-7-15(8-6-14)12-26-19(27)17-18(23(2)21(26)28)22-20-24(9-10-25(17)20)13-16-4-3-11-29-16/h3-8,11H,9-10,12-13H2,1-2H3