6-(4-bromophenyl)-4,7-dimethyl-2-(2-piperidin-1-ylethyl)purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 6-(4-bromophenyl)-4,7-dimethyl-2-(2-piperidin-1-ylethyl)purino[7,8-a]imidazole-1,3-dione Openeye Name: 6-(4-bromophenyl)-4,7-dimethyl-2-[2-(1-piperidyl)ethyl]purino[7,8-a]imidazole-1,3-dione CAS Name: 6-(4-bromophenyl)-4,7-dimethyl-2-[2-(1-piperidinyl)ethyl]purino[7,8-a]imidazole-1,3-dione IUPAC Name: 6-(4-bromophenyl)-4,7-dimethyl-2-(2-piperidin-1-ylethyl)purino[7,8-a]imidazole-1,3-dione Traditional Name: 6-(4-bromophenyl)-4,7-dimethyl-2-(2-piperidinoethyl)purin[7,8-a]imidazole-1,3-quinone Formula: C22H25BrN6O2 MolecularWeight: 485.3769

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C3=C(N=C2N1C4=CC=C(C=C4)Br)N(C(=O)N(C3=O)CCN5CCCCC5)C

Isomeric SMILES

CC1=CN2C3=C(N=C2N1C4=CC=C(C=C4)Br)N(C(=O)N(C3=O)CCN5CCCCC5)C

InChI

InChI=1S/C22H25BrN6O2/c1-15-14-28-18-19(24-21(28)29(15)17-8-6-16(23)7-9-17)25(2)22(31)27(20(18)30)13-12-26-10-4-3-5-11-26/h6-9,14H,3-5,10-13H2,1-2H3