1-methyl-7-oxidanyl-9-phenyl-3-propyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione

Systemtic Name: 1-methyl-7-oxidanyl-9-phenyl-3-propyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione Openeye Name: 7-hydroxy-1-methyl-9-phenyl-3-propyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione CAS Name: 7-hydroxy-1-methyl-9-phenyl-3-propyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione IUPAC Name: 7-hydroxy-1-methyl-9-phenyl-3-propyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione Traditional Name: 7-hydroxy-1-methyl-9-phenyl-3-propyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-quinone Formula: C18H21N5O3 MolecularWeight: 355.39104

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(N=C3N2CC(CN3C4=CC=CC=C4)O)N(C1=O)C

Isomeric SMILES

CCCN1C(=O)C2=C(N=C3N2CC(CN3C4=CC=CC=C4)O)N(C1=O)C

InChI

InChI=1S/C18H21N5O3/c1-3-9-21-16(25)14-15(20(2)18(21)26)19-17-22(10-13(24)11-23(14)17)12-7-5-4-6-8-12/h4-8,13,24H,3,9-11H2,1-2H3