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

Systemtic Name: 6-(2-dimethylaminoethyl)-4,7-dimethyl-2-(3-phenylpropyl)purino[7,8-a]imidazole-1,3-dione Openeye Name: 6-(2-dimethylaminoethyl)-4,7-dimethyl-2-(3-phenylpropyl)purino[7,8-a]imidazole-1,3-dione CAS Name: 6-(2-dimethylaminoethyl)-4,7-dimethyl-2-(3-phenylpropyl)purino[7,8-a]imidazole-1,3-dione IUPAC Name: 6-(2-dimethylaminoethyl)-4,7-dimethyl-2-(3-phenylpropyl)purino[7,8-a]imidazole-1,3-dione Traditional Name: 6-(2-dimethylaminoethyl)-4,7-dimethyl-2-(3-phenylpropyl)purin[7,8-a]imidazole-1,3-quinone Formula: C22H28N6O2 MolecularWeight: 408.49672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C3=C(N=C2N1CCN(C)C)N(C(=O)N(C3=O)CCCC4=CC=CC=C4)C

Isomeric SMILES

CC1=CN2C3=C(N=C2N1CCN(C)C)N(C(=O)N(C3=O)CCCC4=CC=CC=C4)C

InChI

InChI=1S/C22H28N6O2/c1-16-15-28-18-19(23-21(28)26(16)14-13-24(2)3)25(4)22(30)27(20(18)29)12-8-11-17-9-6-5-7-10-17/h5-7,9-10,15H,8,11-14H2,1-4H3