8-cyclohexyl-3-(phenylmethyl)-1-propyl-7-(2-trimethylsilylethoxymethyl)purine-2,6-dione

Systemtic Name: 8-cyclohexyl-3-(phenylmethyl)-1-propyl-7-(2-trimethylsilylethoxymethyl)purine-2,6-dione Openeye Name: 3-benzyl-8-cyclohexyl-1-propyl-7-(2-trimethylsilylethoxymethyl)purine-2,6-dione CAS Name: 8-cyclohexyl-3-(phenylmethyl)-1-propyl-7-(2-trimethylsilylethoxymethyl)purine-2,6-dione IUPAC Name: 3-benzyl-8-cyclohexyl-1-propyl-7-(2-trimethylsilylethoxymethyl)purine-2,6-dione Traditional Name: 3-benzyl-8-cyclohexyl-1-propyl-7-(2-trimethylsilylethoxymethyl)xanthine Formula: C27H40N4O3Si MolecularWeight: 496.717

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(N=C(N2COCC[Si](C)(C)C)C3CCCCC3)N(C1=O)CC4=CC=CC=C4

Isomeric SMILES

CCCN1C(=O)C2=C(N=C(N2COCC[Si](C)(C)C)C3CCCCC3)N(C1=O)CC4=CC=CC=C4

InChI

InChI=1S/C27H40N4O3Si/c1-5-16-29-26(32)23-25(30(27(29)33)19-21-12-8-6-9-13-21)28-24(22-14-10-7-11-15-22)31(23)20-34-17-18-35(2,3)4/h6,8-9,12-13,22H,5,7,10-11,14-20H2,1-4H3