(7S)-3-ethyl-1,7-dimethyl-9-phenethyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione

Systemtic Name: (7S)-3-ethyl-1,7-dimethyl-9-phenethyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione Openeye Name: (7S)-3-ethyl-1,7-dimethyl-9-phenethyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione CAS Name: (7S)-3-ethyl-1,7-dimethyl-9-phenethyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione IUPAC Name: (7S)-3-ethyl-1,7-dimethyl-9-phenethyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione Traditional Name: (7S)-3-ethyl-1,7-dimethyl-9-phenethyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-quinone Formula: C20H25N5O2 MolecularWeight: 367.4448

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(N=C3N2CC(CN3CCC4=CC=CC=C4)C)N(C1=O)C

Isomeric SMILES

CCN1C(=O)C2=C(N=C3N2C[C@H](CN3CCC4=CC=CC=C4)C)N(C1=O)C

InChI

InChI=1S/C20H25N5O2/c1-4-24-18(26)16-17(22(3)20(24)27)21-19-23(12-14(2)13-25(16)19)11-10-15-8-6-5-7-9-15/h5-9,14H,4,10-13H2,1-3H3/t14-/m0/s1