2,4,7-trimethyl-6-phenethyl-purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 2,4,7-trimethyl-6-phenethyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 2,4,7-trimethyl-6-phenethyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 2,4,7-trimethyl-6-phenethylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 2,4,7-trimethyl-6-phenethylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 2,4,7-trimethyl-6-phenethyl-purin[7,8-a]imidazole-1,3-quinone Formula: C18H19N5O2 MolecularWeight: 337.37576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C3=C(N=C2N1CCC4=CC=CC=C4)N(C(=O)N(C3=O)C)C

Isomeric SMILES

CC1=CN2C3=C(N=C2N1CCC4=CC=CC=C4)N(C(=O)N(C3=O)C)C

InChI

InChI=1S/C18H19N5O2/c1-12-11-23-14-15(20(2)18(25)21(3)16(14)24)19-17(23)22(12)10-9-13-7-5-4-6-8-13/h4-8,11H,9-10H2,1-3H3