2-[(5S)-5-(dimethylamino)hexyl]-4-methyl-5,7,8,9a-tetrahydro-4aH-purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 2-[(5S)-5-(dimethylamino)hexyl]-4-methyl-5,7,8,9a-tetrahydro-4aH-purino[7,8-a]imidazole-1,3-dione Openeye Name: 2-[(5S)-5-(dimethylamino)hexyl]-4-methyl-5,7,8,9a-tetrahydro-4aH-purino[7,8-a]imidazole-1,3-dione CAS Name: 2-[(5S)-5-(dimethylamino)hexyl]-4-methyl-5,7,8,9a-tetrahydro-4aH-purino[7,8-a]imidazole-1,3-dione IUPAC Name: 2-[(5S)-5-(dimethylamino)hexyl]-4-methyl-5,7,8,9a-tetrahydro-4aH-purino[7,8-a]imidazole-1,3-dione Traditional Name: 2-[(5S)-5-(dimethylamino)hexyl]-4-methyl-5,7,8,9a-tetrahydro-4aH-purin[7,8-a]imidazole-1,3-quinone Formula: C16H28N6O2 MolecularWeight: 336.43252

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCN1C(=O)C2C(NC3=NCCN23)N(C1=O)C)N(C)C

Isomeric SMILES

C[C@@H](CCCCN1C(=O)C2C(NC3=NCCN23)N(C1=O)C)N(C)C

InChI

InChI=1S/C16H28N6O2/c1-11(19(2)3)7-5-6-9-22-14(23)12-13(20(4)16(22)24)18-15-17-8-10-21(12)15/h11-13H,5-10H2,1-4H3,(H,17,18)/t11-,12?,13?/m0/s1