2-cyclopentyl-5-(3-methylsulfonylpropoxy)-8-(phenylmethyl)-7,8-dihydro-1H-imidazo[2,1-f]purine

Systemtic Name: 2-cyclopentyl-5-(3-methylsulfonylpropoxy)-8-(phenylmethyl)-7,8-dihydro-1H-imidazo[2,1-f]purine Openeye Name: 8-benzyl-2-cyclopentyl-5-(3-methylsulfonylpropoxy)-7,8-dihydro-1H-imidazo[2,1-f]purine CAS Name: 2-cyclopentyl-5-(3-methylsulfonylpropoxy)-8-(phenylmethyl)-7,8-dihydro-1H-imidazo[2,1-f]purine IUPAC Name: 8-benzyl-2-cyclopentyl-5-(3-methylsulfonylpropoxy)-7,8-dihydro-1H-imidazo[2,1-f]purine Traditional Name: 8-benzyl-2-cyclopentyl-5-(3-mesylpropoxy)-7,8-dihydro-1H-imidazo[2,1-f]purine Formula: C23H29N5O3S MolecularWeight: 455.57306

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCCOC1=NC2=C(C3=NC(CN31)CC4=CC=CC=C4)NC(=N2)C5CCCC5

Isomeric SMILES

CS(=O)(=O)CCCOC1=NC2=C(C3=NC(CN31)CC4=CC=CC=C4)NC(=N2)C5CCCC5

InChI

InChI=1S/C23H29N5O3S/c1-32(29,30)13-7-12-31-23-27-21-19(25-20(26-21)17-10-5-6-11-17)22-24-18(15-28(22)23)14-16-8-3-2-4-9-16/h2-4,8-9,17-18H,5-7,10-15H2,1H3,(H,25,26)