7-ethyl-9-(4-fluorophenyl)-1,3-dimethyl-6-oxidanyl-purino[7,8-a]pyrimidine-2,4,8-trione

Systemtic Name: 7-ethyl-9-(4-fluorophenyl)-1,3-dimethyl-6-oxidanyl-purino[7,8-a]pyrimidine-2,4,8-trione Openeye Name: 7-ethyl-9-(4-fluorophenyl)-6-hydroxy-1,3-dimethyl-purino[7,8-a]pyrimidine-2,4,8-trione CAS Name: 7-ethyl-9-(4-fluorophenyl)-6-hydroxy-1,3-dimethylpurino[7,8-a]pyrimidine-2,4,8-trione IUPAC Name: 7-ethyl-9-(4-fluorophenyl)-6-hydroxy-1,3-dimethylpurino[7,8-a]pyrimidine-2,4,8-trione Traditional Name: 7-ethyl-9-(4-fluorophenyl)-6-hydroxy-1,3-dimethyl-purino[7,8-a]pyrimidine-2,4,8-trione Formula: C18H16FN5O4 MolecularWeight: 385.349143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N2C3=C(N=C2N(C1=O)C4=CC=C(C=C4)F)N(C(=O)N(C3=O)C)C)O

Isomeric SMILES

CCC1=C(N2C3=C(N=C2N(C1=O)C4=CC=C(C=C4)F)N(C(=O)N(C3=O)C)C)O

InChI

InChI=1S/C18H16FN5O4/c1-4-11-14(25)23(10-7-5-9(19)6-8-10)17-20-13-12(24(17)15(11)26)16(27)22(3)18(28)21(13)2/h5-8,26H,4H2,1-3H3