4,7-dimethyl-6-(2-propoxyphenyl)-2-propyl-purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 4,7-dimethyl-6-(2-propoxyphenyl)-2-propyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 4,7-dimethyl-6-(2-propoxyphenyl)-2-propyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 4,7-dimethyl-6-(2-propoxyphenyl)-2-propylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 4,7-dimethyl-6-(2-propoxyphenyl)-2-propylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 4,7-dimethyl-6-(2-propoxyphenyl)-2-propyl-purin[7,8-a]imidazole-1,3-quinone Formula: C21H25N5O3 MolecularWeight: 395.4549

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(N=C3N2C=C(N3C4=CC=CC=C4OCCC)C)N(C1=O)C

Isomeric SMILES

CCCN1C(=O)C2=C(N=C3N2C=C(N3C4=CC=CC=C4OCCC)C)N(C1=O)C

InChI

InChI=1S/C21H25N5O3/c1-5-11-24-19(27)17-18(23(4)21(24)28)22-20-25(17)13-14(3)26(20)15-9-7-8-10-16(15)29-12-6-2/h7-10,13H,5-6,11-12H2,1-4H3