1-methyl-3-phenyl-9-(phenylmethyl)-7-propyl-4H-purino[8,7-c][1,2,4]triazine-6,8-dione

Systemtic Name: 1-methyl-3-phenyl-9-(phenylmethyl)-7-propyl-4H-purino[8,7-c][1,2,4]triazine-6,8-dione Openeye Name: 9-benzyl-1-methyl-3-phenyl-7-propyl-4H-purino[8,7-c][1,2,4]triazine-6,8-dione CAS Name: 1-methyl-3-phenyl-9-(phenylmethyl)-7-propyl-4H-purino[8,7-c][1,2,4]triazine-6,8-dione IUPAC Name: 9-benzyl-1-methyl-3-phenyl-7-propyl-4H-purino[8,7-c][1,2,4]triazine-6,8-dione Traditional Name: 9-benzyl-1-methyl-3-phenyl-7-propyl-4H-purino[8,7-c][1,2,4]triazine-6,8-quinone Formula: C24H24N6O2 MolecularWeight: 428.48636

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(N=C3N2CC(=NN3C)C4=CC=CC=C4)N(C1=O)CC5=CC=CC=C5

Isomeric SMILES

CCCN1C(=O)C2=C(N=C3N2CC(=NN3C)C4=CC=CC=C4)N(C1=O)CC5=CC=CC=C5

InChI

InChI=1S/C24H24N6O2/c1-3-14-28-22(31)20-21(30(24(28)32)15-17-10-6-4-7-11-17)25-23-27(2)26-19(16-29(20)23)18-12-8-5-9-13-18/h4-13H,3,14-16H2,1-2H3