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

Systemtic Name: 6-(4-butylphenyl)-4,7-dimethyl-2-(2-piperidin-1-ylethyl)purino[7,8-a]imidazole-1,3-dione Openeye Name: 6-(4-butylphenyl)-4,7-dimethyl-2-[2-(1-piperidyl)ethyl]purino[7,8-a]imidazole-1,3-dione CAS Name: 6-(4-butylphenyl)-4,7-dimethyl-2-[2-(1-piperidinyl)ethyl]purino[7,8-a]imidazole-1,3-dione IUPAC Name: 6-(4-butylphenyl)-4,7-dimethyl-2-(2-piperidin-1-ylethyl)purino[7,8-a]imidazole-1,3-dione Traditional Name: 6-(4-butylphenyl)-4,7-dimethyl-2-(2-piperidinoethyl)purin[7,8-a]imidazole-1,3-quinone Formula: C26H34N6O2 MolecularWeight: 462.58716

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2C(=CN3C2=NC4=C3C(=O)N(C(=O)N4C)CCN5CCCCC5)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2C(=CN3C2=NC4=C3C(=O)N(C(=O)N4C)CCN5CCCCC5)C

InChI

InChI=1S/C26H34N6O2/c1-4-5-9-20-10-12-21(13-11-20)32-19(2)18-31-22-23(27-25(31)32)28(3)26(34)30(24(22)33)17-16-29-14-7-6-8-15-29/h10-13,18H,4-9,14-17H2,1-3H3