N-(2-methylpropyl)-9-(oxan-2-yl)-N-(phenylmethyl)purin-6-amine

Systemtic Name: N-(2-methylpropyl)-9-(oxan-2-yl)-N-(phenylmethyl)purin-6-amine Openeye Name: N-benzyl-N-isobutyl-9-tetrahydropyran-2-yl-purin-6-amine CAS Name: N-(2-methylpropyl)-9-(2-oxanyl)-N-(phenylmethyl)-6-purinamine IUPAC Name: N-benzyl-N-(2-methylpropyl)-9-(oxan-2-yl)purin-6-amine Traditional Name: benzyl-isobutyl-(9-tetrahydropyran-2-ylpurin-6-yl)amine Formula: C21H27N5O MolecularWeight: 365.47198

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC1=CC=CC=C1)C2=NC=NC3=C2N=CN3C4CCCCO4

Isomeric SMILES

CC(C)CN(CC1=CC=CC=C1)C2=NC=NC3=C2N=CN3C4CCCCO4

InChI

InChI=1S/C21H27N5O/c1-16(2)12-25(13-17-8-4-3-5-9-17)20-19-21(23-14-22-20)26(15-24-19)18-10-6-7-11-27-18/h3-5,8-9,14-16,18H,6-7,10-13H2,1-2H3