8-[cyclohexyl(2-hydroxyethyl)amino]-1-methyl-7-(phenylmethyl)purin-6-one

Systemtic Name: 8-[cyclohexyl(2-hydroxyethyl)amino]-1-methyl-7-(phenylmethyl)purin-6-one Openeye Name: 7-benzyl-8-[cyclohexyl(2-hydroxyethyl)amino]-1-methyl-purin-6-one CAS Name: 8-[cyclohexyl(2-hydroxyethyl)amino]-1-methyl-7-(phenylmethyl)-6-purinone IUPAC Name: 7-benzyl-8-[cyclohexyl(2-hydroxyethyl)amino]-1-methylpurin-6-one Traditional Name: 7-benzyl-8-[cyclohexyl(2-hydroxyethyl)amino]-1-methyl-purin-6-one Formula: C21H27N5O2 MolecularWeight: 381.47138

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C(C1=O)N(C(=N2)N(CCO)C3CCCCC3)CC4=CC=CC=C4

Isomeric SMILES

CN1C=NC2=C(C1=O)N(C(=N2)N(CCO)C3CCCCC3)CC4=CC=CC=C4

InChI

InChI=1S/C21H27N5O2/c1-24-15-22-19-18(20(24)28)26(14-16-8-4-2-5-9-16)21(23-19)25(12-13-27)17-10-6-3-7-11-17/h2,4-5,8-9,15,17,27H,3,6-7,10-14H2,1H3