N-[3-(2-butyl-3-phenyl-oxan-2-yl)piperidin-1-yl]-9-cyclopentyl-6H-purin-1-amine

Systemtic Name: N-[3-(2-butyl-3-phenyl-oxan-2-yl)piperidin-1-yl]-9-cyclopentyl-6H-purin-1-amine Openeye Name: N-[3-(2-butyl-3-phenyl-tetrahydropyran-2-yl)-1-piperidyl]-9-cyclopentyl-6H-purin-1-amine CAS Name: N-[3-(2-butyl-3-phenyl-2-oxanyl)-1-piperidinyl]-9-cyclopentyl-6H-purin-1-amine IUPAC Name: N-[3-(2-butyl-3-phenyloxan-2-yl)piperidin-1-yl]-9-cyclopentyl-6H-purin-1-amine Traditional Name: [3-(2-butyl-3-phenyl-tetrahydropyran-2-yl)piperidino]-(9-cyclopentyl-6H-purin-1-yl)amine Formula: C30H44N6O MolecularWeight: 504.70996

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(C(CCCO1)C2=CC=CC=C2)C3CCCN(C3)NN4CC5=C(N=C4)N(C=N5)C6CCCC6

Isomeric SMILES

CCCCC1(C(CCCO1)C2=CC=CC=C2)C3CCCN(C3)NN4CC5=C(N=C4)N(C=N5)C6CCCC6

InChI

InChI=1S/C30H44N6O/c1-2-3-17-30(27(16-10-19-37-30)24-11-5-4-6-12-24)25-13-9-18-34(20-25)33-35-21-28-29(32-22-35)36(23-31-28)26-14-7-8-15-26/h4-6,11-12,22-23,25-27,33H,2-3,7-10,13-21H2,1H3