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

Systemtic Name: 6-(2-dimethylaminoethyl)-4,7-dimethyl-2-phenethyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 6-(2-dimethylaminoethyl)-4,7-dimethyl-2-phenethyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 6-(2-dimethylaminoethyl)-4,7-dimethyl-2-phenethylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 6-(2-dimethylaminoethyl)-4,7-dimethyl-2-phenethylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 6-(2-dimethylaminoethyl)-4,7-dimethyl-2-phenethyl-purin[7,8-a]imidazole-1,3-quinone Formula: C21H26N6O2 MolecularWeight: 394.47014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C3=C(N=C2N1CCN(C)C)N(C(=O)N(C3=O)CCC4=CC=CC=C4)C

Isomeric SMILES

CC1=CN2C3=C(N=C2N1CCN(C)C)N(C(=O)N(C3=O)CCC4=CC=CC=C4)C

InChI

InChI=1S/C21H26N6O2/c1-15-14-27-17-18(22-20(27)25(15)13-12-23(2)3)24(4)21(29)26(19(17)28)11-10-16-8-6-5-7-9-16/h5-9,14H,10-13H2,1-4H3