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1-cyclohexyl-3-phenyl-7-(1-phenylethyl)purine-2,6-dione

1-cyclohexyl-3-phenyl-7-(1-phenylethyl)purine-2,6-dione

Systemtic Name:1-cyclohexyl-3-phenyl-7-(1-phenylethyl)purine-2,6-dione
Openeye Name:1-cyclohexyl-3-phenyl-7-(1-phenylethyl)purine-2,6-dione
CAS Name:1-cyclohexyl-3-phenyl-7-(1-phenylethyl)purine-2,6-dione
IUPAC Name:1-cyclohexyl-3-phenyl-7-(1-phenylethyl)purine-2,6-dione
Traditional Name:1-cyclohexyl-3-phenyl-7-(1-phenylethyl)xanthine
Formula: C25H26N4O2
MolecularWeight: 414.49954
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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N2C=NC3=C2C(=O)N(C(=O)N3C4=CC=CC=C4)C5CCCCC5


Isomeric SMILES

CC(C1=CC=CC=C1)N2C=NC3=C2C(=O)N(C(=O)N3C4=CC=CC=C4)C5CCCCC5


InChI

InChI=1S/C25H26N4O2/c1-18(19-11-5-2-6-12-19)27-17-26-23-22(27)24(30)29(21-15-9-4-10-16-21)25(31)28(23)20-13-7-3-8-14-20/h2-3,5-8,11-14,17-18,21H,4,9-10,15-16H2,1H3


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