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7-(2-chlorophenyl)-3-cyclopentyl-8-piperazin-1-yl-purine-2,6-dione

7-(2-chlorophenyl)-3-cyclopentyl-8-piperazin-1-yl-purine-2,6-dione

Systemtic Name:7-(2-chlorophenyl)-3-cyclopentyl-8-piperazin-1-yl-purine-2,6-dione
Openeye Name:7-(2-chlorophenyl)-3-cyclopentyl-8-piperazin-1-yl-purine-2,6-dione
CAS Name:7-(2-chlorophenyl)-3-cyclopentyl-8-(1-piperazinyl)purine-2,6-dione
IUPAC Name:7-(2-chlorophenyl)-3-cyclopentyl-8-piperazin-1-ylpurine-2,6-dione
Traditional Name:7-(2-chlorophenyl)-3-cyclopentyl-8-piperazino-xanthine
Formula: C20H23ClN6O2
MolecularWeight: 414.88862
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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C3=C(C(=O)NC2=O)N(C(=N3)N4CCNCC4)C5=CC=CC=C5Cl


Isomeric SMILES

C1CCC(C1)N2C3=C(C(=O)NC2=O)N(C(=N3)N4CCNCC4)C5=CC=CC=C5Cl


InChI

InChI=1S/C20H23ClN6O2/c21-14-7-3-4-8-15(14)27-16-17(23-19(27)25-11-9-22-10-12-25)26(13-5-1-2-6-13)20(29)24-18(16)28/h3-4,7-8,13,22H,1-2,5-6,9-12H2,(H,24,28,29)


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