2-[1-[[2-[(4-azanylcyclohexyl)amino]-9-cyclopentyl-purin-6-yl]amino]piperidin-4-yl]-1-phenyl-ethanol

Systemtic Name: 2-[1-[[2-[(4-azanylcyclohexyl)amino]-9-cyclopentyl-purin-6-yl]amino]piperidin-4-yl]-1-phenyl-ethanol Openeye Name: 2-[1-[[2-[(4-aminocyclohexyl)amino]-9-cyclopentyl-purin-6-yl]amino]-4-piperidyl]-1-phenyl-ethanol CAS Name: 2-[1-[[2-[(4-aminocyclohexyl)amino]-9-cyclopentyl-6-purinyl]amino]-4-piperidinyl]-1-phenylethanol IUPAC Name: 2-[1-[[2-[(4-aminocyclohexyl)amino]-9-cyclopentylpurin-6-yl]amino]piperidin-4-yl]-1-phenylethanol Traditional Name: 2-[1-[[2-[(4-aminocyclohexyl)amino]-9-cyclopentyl-purin-6-yl]amino]-4-piperidyl]-1-phenyl-ethanol Formula: C29H42N8O MolecularWeight: 518.69678

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C=NC3=C2N=C(N=C3NN4CCC(CC4)CC(C5=CC=CC=C5)O)NC6CCC(CC6)N

Isomeric SMILES

C1CCC(C1)N2C=NC3=C2N=C(N=C3NN4CCC(CC4)CC(C5=CC=CC=C5)O)NC6CCC(CC6)N

InChI

InChI=1S/C29H42N8O/c30-22-10-12-23(13-11-22)32-29-33-27(26-28(34-29)37(19-31-26)24-8-4-5-9-24)35-36-16-14-20(15-17-36)18-25(38)21-6-2-1-3-7-21/h1-3,6-7,19-20,22-25,38H,4-5,8-18,30H2,(H2,32,33,34,35)